methyl 3-[4-[1-[3-(2-azanylethyl)phenyl]-3-methoxy-5-oxidanylidene-2H-pyrrol-4-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[1-[3-(2-azanylethyl)phenyl]-3-methoxy-5-oxidanylidene-2H-pyrrol-4-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[1-[3-(2-aminoethyl)phenyl]-3-methoxy-5-oxo-2H-pyrrol-4-yl]phenyl]propanoate CAS Name: 3-[4-[1-[3-(2-aminoethyl)phenyl]-3-methoxy-5-oxo-2H-pyrrol-4-yl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[1-[3-(2-aminoethyl)phenyl]-3-methoxy-5-oxo-2H-pyrrol-4-yl]phenyl]propanoate Traditional Name: 3-[4-[1-[3-(2-aminoethyl)phenyl]-2-keto-4-methoxy-3-pyrrolin-3-yl]phenyl]propionic acid methyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)N(C1)C2=CC=CC(=C2)CCN)C3=CC=C(C=C3)CCC(=O)OC

Isomeric SMILES

COC1=C(C(=O)N(C1)C2=CC=CC(=C2)CCN)C3=CC=C(C=C3)CCC(=O)OC

InChI

InChI=1S/C23H26N2O4/c1-28-20-15-25(19-5-3-4-17(14-19)12-13-24)23(27)22(20)18-9-6-16(7-10-18)8-11-21(26)29-2/h3-7,9-10,14H,8,11-13,15,24H2,1-2H3