2-[(3-cyanophenyl)carbamoylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[(3-cyanophenyl)carbamoylamino]-3-methyl-pentanoic acid Openeye Name: 2-[(3-cyanophenyl)carbamoylamino]-3-methyl-pentanoic acid CAS Name: 2-[[(3-cyanoanilino)-oxomethyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[(3-cyanophenyl)carbamoylamino]-3-methylpentanoic acid Traditional Name: 2-[(3-cyanophenyl)carbamoylamino]-3-methyl-valeric acid Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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