2-(naphthalen-1-ylmethyl)-4-oxidanylidene-4-[(phenylmethyl)amino]butanoic acid

Systemtic Name: 2-(naphthalen-1-ylmethyl)-4-oxidanylidene-4-[(phenylmethyl)amino]butanoic acid Openeye Name: 4-(benzylamino)-2-(1-naphthylmethyl)-4-oxo-butanoic acid CAS Name: 2-(1-naphthalenylmethyl)-4-oxo-4-[(phenylmethyl)amino]butanoic acid IUPAC Name: 4-(benzylamino)-2-(naphthalen-1-ylmethyl)-4-oxobutanoic acid Traditional Name: 4-(benzylamino)-4-keto-2-(1-naphthylmethyl)butyric acid Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CC(CC2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CC(CC2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C22H21NO3/c24-21(23-15-16-7-2-1-3-8-16)14-19(22(25)26)13-18-11-6-10-17-9-4-5-12-20(17)18/h1-12,19H,13-15H2,(H,23,24)(H,25,26)