(E)-[1-(3-dimethylammoniopropyl)-4,5-dioxo-2-pyridin-4-yl-pyrrolidin-3-ylidene]-(3-methyl-4-phenylmethoxy-phenyl)methanolate

Molecular Formula: C29H31N3O4


InChI: InChI=1/C29H31N3O4/c1-20-18-23(10-11-24(20)36-19-21-8-5-4-6-9-21)27(33)25-26(22-12-14-30-15-13-22)32(29(35)28(25)34)17-7-16-31(2)3/h4-6,8-15,18,26,33H,7,16-17,19H2,1-3H3/b27-25+/f/h33h,31H

InChIKey: InChIKey=MLLLNGZXPFDROS-LWFCOTHWDC
SMILES: CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCC[NH+](C)C)C3=CC=NC=C3)[O-])OCC4=CC=CC=C4

Names:
    (E)-[1-(3-dimethylammoniopropyl)-4,5-dioxo-2-pyridin-4-yl-pyrrolidin-3-ylidene]-(3-methyl-4-phenylmethoxy-phenyl)methanolate

Registries:
    PubChem CID 6306046
    PubChem ID 11595681