2-[4-[4-(4-azanylbutyl)phenyl]-3-methanoyl-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[4-[4-(4-azanylbutyl)phenyl]-3-methanoyl-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[4-[4-(4-aminobutyl)phenyl]-3-formyl-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[4-[4-(4-aminobutyl)phenyl]-3-formyl-2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[4-[4-(4-aminobutyl)phenyl]-3-formyl-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[4-[4-(4-aminobutyl)phenyl]-3-formyl-2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Formula: C26H32N2O4 MolecularWeight: 436.54328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)N1CCCC2=CC=CC=C2)(CC(=O)O)C=O)C3=CC=C(C=C3)CCCCN

Isomeric SMILES

C1C(C(C(=O)N1CCCC2=CC=CC=C2)(CC(=O)O)C=O)C3=CC=C(C=C3)CCCCN

InChI

InChI=1S/C26H32N2O4/c27-15-5-4-9-21-11-13-22(14-12-21)23-18-28(16-6-10-20-7-2-1-3-8-20)25(32)26(23,19-29)17-24(30)31/h1-3,7-8,11-14,19,23H,4-6,9-10,15-18,27H2,(H,30,31)