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

Systemtic Name: methyl 2-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-3-chloranyl-4-methyl-benzoate Openeye Name: methyl 2-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-3-chloro-4-methyl-benzoate CAS Name: 2-[[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)amino]-oxomethyl]-3-chloro-4-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)carbamoyl]-3-chloro-4-methylbenzoate Traditional Name: 2-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-3-chloro-4-methyl-benzoic acid methyl ester Formula: C16H21ClN2O4 MolecularWeight: 340.80194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21ClN2O4/c1-8(2)16(4,15(18)22)19-13(20)11-10(14(21)23-5)7-6-9(3)12(11)17/h6-8H,1-5H3,(H2,18,22)(H,19,20)