methyl 3-[[[4-(2-methylpropanoylamino)phenyl]carbonylamino]carbamoyl]benzoate

Systemtic Name: methyl 3-[[[4-(2-methylpropanoylamino)phenyl]carbonylamino]carbamoyl]benzoate Openeye Name: methyl 3-[[[4-(2-methylpropanoylamino)benzoyl]amino]carbamoyl]benzoate CAS Name: 3-[[[[4-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethyl]hydrazo]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[[4-(2-methylpropanoylamino)benzoyl]amino]carbamoyl]benzoate Traditional Name: 3-[[[4-(isobutyrylamino)benzoyl]amino]carbamoyl]benzoic acid methyl ester Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C20H21N3O5/c1-12(2)17(24)21-16-9-7-13(8-10-16)18(25)22-23-19(26)14-5-4-6-15(11-14)20(27)28-3/h4-12H,1-3H3,(H,21,24)(H,22,25)(H,23,26)