methyl 3-[4-[1-[4-(1-azanylethyl)phenyl]-2-oxidanylidene-pyrrolidin-3-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[1-[4-(1-azanylethyl)phenyl]-2-oxidanylidene-pyrrolidin-3-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[1-[4-(1-aminoethyl)phenyl]-2-oxo-pyrrolidin-3-yl]phenyl]propanoate CAS Name: 3-[4-[1-[4-(1-aminoethyl)phenyl]-2-oxo-3-pyrrolidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[1-[4-(1-aminoethyl)phenyl]-2-oxopyrrolidin-3-yl]phenyl]propanoate Traditional Name: 3-[4-[1-[4-(1-aminoethyl)phenyl]-2-keto-pyrrolidin-3-yl]phenyl]propionic acid methyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2CCC(C2=O)C3=CC=C(C=C3)CCC(=O)OC)N

Isomeric SMILES

CC(C1=CC=C(C=C1)N2CCC(C2=O)C3=CC=C(C=C3)CCC(=O)OC)N

InChI

InChI=1S/C22H26N2O3/c1-15(23)17-8-10-19(11-9-17)24-14-13-20(22(24)26)18-6-3-16(4-7-18)5-12-21(25)27-2/h3-4,6-11,15,20H,5,12-14,23H2,1-2H3