(2R)-4-[(4-ethylphenyl)amino]-4-oxidanylidene-2-(pyridin-3-ylmethylamino)butanoic acid

Systemtic Name: (2R)-4-[(4-ethylphenyl)amino]-4-oxidanylidene-2-(pyridin-3-ylmethylamino)butanoic acid Openeye Name: (2R)-4-(4-ethylanilino)-4-oxo-2-(3-pyridylmethylamino)butanoic acid CAS Name: (2R)-4-(4-ethylanilino)-4-oxo-2-(3-pyridinylmethylamino)butanoic acid IUPAC Name: (2R)-4-(4-ethylanilino)-4-oxo-2-(pyridin-3-ylmethylamino)butanoic acid Traditional Name: (2R)-4-(4-ethylanilino)-4-keto-2-(3-pyridylmethylamino)butyric acid Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CC(C(=O)O)NCC2=CN=CC=C2

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C[C@H](C(=O)O)NCC2=CN=CC=C2

InChI

InChI=1S/C18H21N3O3/c1-2-13-5-7-15(8-6-13)21-17(22)10-16(18(23)24)20-12-14-4-3-9-19-11-14/h3-9,11,16,20H,2,10,12H2,1H3,(H,21,22)(H,23,24)/t16-/m1/s1