2-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)carbamoyl]benzoic acid Openeye Name: 2-[(1-carbamoyl-3-methyl-butyl)carbamoyl]benzoic acid CAS Name: 2-[[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(1-amino-4-methyl-1-oxopentan-2-yl)carbamoyl]benzoic acid Traditional Name: 2-[(1-carbamoyl-3-methyl-butyl)carbamoyl]benzoic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(C)CC(C(=O)N)NC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C14H18N2O4/c1-8(2)7-11(12(15)17)16-13(18)9-5-3-4-6-10(9)14(19)20/h3-6,8,11H,7H2,1-2H3,(H2,15,17)(H,16,18)(H,19,20)