2-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-3-chloranyl-4-methyl-benzoic acid

Systemtic Name: 2-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-3-chloranyl-4-methyl-benzoic acid Openeye Name: 2-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-3-chloro-4-methyl-benzoic acid CAS Name: 2-[[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)amino]-oxomethyl]-3-chloro-4-methylbenzoic acid IUPAC Name: 2-[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)carbamoyl]-3-chloro-4-methylbenzoic acid Traditional Name: 2-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-3-chloro-4-methyl-benzoic acid Formula: C15H19ClN2O4 MolecularWeight: 326.77536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)O)C(=O)NC(C)(C(C)C)C(=O)N)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)O)C(=O)NC(C)(C(C)C)C(=O)N)Cl

InChI

InChI=1S/C15H19ClN2O4/c1-7(2)15(4,14(17)22)18-12(19)10-9(13(20)21)6-5-8(3)11(10)16/h5-7H,1-4H3,(H2,17,22)(H,18,19)(H,20,21)