(3S)-3-(naphthalen-2-ylcarbonylamino)-4-oxidanylidene-4-(phenethylamino)butanoic acid

Systemtic Name: (3S)-3-(naphthalen-2-ylcarbonylamino)-4-oxidanylidene-4-(phenethylamino)butanoic acid Openeye Name: (3S)-3-(naphthalene-2-carbonylamino)-4-oxo-4-(phenethylamino)butanoic acid CAS Name: (3S)-3-[[2-naphthalenyl(oxo)methyl]amino]-4-oxo-4-(phenethylamino)butanoic acid IUPAC Name: (3S)-3-(naphthalene-2-carbonylamino)-4-oxo-4-(phenethylamino)butanoic acid Traditional Name: (3S)-4-keto-3-(2-naphthoylamino)-4-(phenethylamino)butyric acid Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(CC(=O)O)NC(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)[C@H](CC(=O)O)NC(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H22N2O4/c26-21(27)15-20(23(29)24-13-12-16-6-2-1-3-7-16)25-22(28)19-11-10-17-8-4-5-9-18(17)14-19/h1-11,14,20H,12-13,15H2,(H,24,29)(H,25,28)(H,26,27)/t20-/m0/s1