methyl 3-[4-[1-(1-azanyl-2,3-dihydro-1H-inden-5-yl)-3-methoxy-5-oxidanylidene-2H-pyrrol-4-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[1-(1-azanyl-2,3-dihydro-1H-inden-5-yl)-3-methoxy-5-oxidanylidene-2H-pyrrol-4-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[1-(1-aminoindan-5-yl)-3-methoxy-5-oxo-2H-pyrrol-4-yl]phenyl]propanoate CAS Name: 3-[4-[1-(1-amino-2,3-dihydro-1H-inden-5-yl)-3-methoxy-5-oxo-2H-pyrrol-4-yl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[1-(1-amino-2,3-dihydro-1H-inden-5-yl)-3-methoxy-5-oxo-2H-pyrrol-4-yl]phenyl]propanoate Traditional Name: 3-[4-[1-(1-aminoindan-5-yl)-2-keto-4-methoxy-3-pyrrolin-3-yl]phenyl]propionic acid methyl ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)N(C1)C2=CC3=C(C=C2)C(CC3)N)C4=CC=C(C=C4)CCC(=O)OC

Isomeric SMILES

COC1=C(C(=O)N(C1)C2=CC3=C(C=C2)C(CC3)N)C4=CC=C(C=C4)CCC(=O)OC

InChI

InChI=1S/C24H26N2O4/c1-29-21-14-26(18-9-10-19-17(13-18)8-11-20(19)25)24(28)23(21)16-6-3-15(4-7-16)5-12-22(27)30-2/h3-4,6-7,9-10,13,20H,5,8,11-12,14,25H2,1-2H3