2-[[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(3-cyanoanilino)-2-oxo-ethyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(3-cyanoanilino)-2-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(3-cyanoanilino)-2-oxoethyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(3-cyanoanilino)-2-keto-ethyl]amino]-3-methyl-butyric acid Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC(=O)NC1=CC=CC(=C1)C#N

Isomeric SMILES

CC(C)C(C(=O)O)NCC(=O)NC1=CC=CC(=C1)C#N

InChI

InChI=1S/C14H17N3O3/c1-9(2)13(14(19)20)16-8-12(18)17-11-5-3-4-10(6-11)7-15/h3-6,9,13,16H,8H2,1-2H3,(H,17,18)(H,19,20)