2-[5-[(6-azanylhexanoylamino)methyl]-1-(2-naphthalen-1-ylethyl)-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-[(6-azanylhexanoylamino)methyl]-1-(2-naphthalen-1-ylethyl)-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[5-[(6-aminohexanoylamino)methyl]-1-[2-(1-naphthyl)ethyl]-2-oxo-pyrrolidin-3-yl]acetic acid CAS Name: 2-[5-[[(6-amino-1-oxohexyl)amino]methyl]-1-[2-(1-naphthalenyl)ethyl]-2-oxo-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[5-[(6-aminohexanoylamino)methyl]-1-(2-naphthalen-1-ylethyl)-2-oxopyrrolidin-3-yl]acetic acid Traditional Name: 2-[5-[(6-aminohexanoylamino)methyl]-2-keto-1-[2-(1-naphthyl)ethyl]pyrrolidin-3-yl]acetic acid Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1CNC(=O)CCCCCN)CCC2=CC=CC3=CC=CC=C32)CC(=O)O

Isomeric SMILES

C1C(C(=O)N(C1CNC(=O)CCCCCN)CCC2=CC=CC3=CC=CC=C32)CC(=O)O

InChI

InChI=1S/C25H33N3O4/c26-13-5-1-2-11-23(29)27-17-21-15-20(16-24(30)31)25(32)28(21)14-12-19-9-6-8-18-7-3-4-10-22(18)19/h3-4,6-10,20-21H,1-2,5,11-17,26H2,(H,27,29)(H,30,31)