2-[(3-cyanophenyl)carbamoylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[(3-cyanophenyl)carbamoylamino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[(3-cyanophenyl)carbamoylamino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[(3-cyanoanilino)-oxomethyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[(3-cyanophenyl)carbamoylamino]-3,3-dimethylbutanoic acid Traditional Name: 2-[(3-cyanophenyl)carbamoylamino]-3,3-dimethyl-butyric acid Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3/c1-14(2,3)11(12(18)19)17-13(20)16-10-6-4-5-9(7-10)8-15/h4-7,11H,1-3H3,(H,18,19)(H2,16,17,20)