2-[5-[(6-cyanonaphthalen-2-yl)oxymethyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-[(6-cyanonaphthalen-2-yl)oxymethyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[5-[(6-cyano-2-naphthyl)oxymethyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[5-[(6-cyano-2-naphthalenyl)oxymethyl]-2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[5-[(6-cyanonaphthalen-2-yl)oxymethyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[5-[(6-cyano-2-naphthoxy)methyl]-2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Formula: C27H26N2O4 MolecularWeight: 442.50634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1COC2=CC3=C(C=C2)C=C(C=C3)C#N)CCCC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

C1C(C(=O)N(C1COC2=CC3=C(C=C2)C=C(C=C3)C#N)CCCC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C27H26N2O4/c28-17-20-8-9-22-15-25(11-10-21(22)13-20)33-18-24-14-23(16-26(30)31)27(32)29(24)12-4-7-19-5-2-1-3-6-19/h1-3,5-6,8-11,13,15,23-24H,4,7,12,14,16,18H2,(H,30,31)