[1-[5-chloranyl-2-[(phenylmethyl)carbamoyl]phenyl]imino-3-methyl-butan-2-yl]carbamic acid

Systemtic Name: [1-[5-chloranyl-2-[(phenylmethyl)carbamoyl]phenyl]imino-3-methyl-butan-2-yl]carbamic acid Openeye Name: [1-[[2-(benzylcarbamoyl)-5-chloro-phenyl]iminomethyl]-2-methyl-propyl]carbamic acid CAS Name: [1-[5-chloro-2-[oxo-[(phenylmethyl)amino]methyl]phenyl]imino-3-methylbutan-2-yl]carbamic acid IUPAC Name: [1-[2-(benzylcarbamoyl)-5-chlorophenyl]imino-3-methylbutan-2-yl]carbamic acid Traditional Name: [1-[[2-(benzylcarbamoyl)-5-chloro-phenyl]iminomethyl]-2-methyl-propyl]carbamic acid Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C=NC1=C(C=CC(=C1)Cl)C(=O)NCC2=CC=CC=C2)NC(=O)O

Isomeric SMILES

CC(C)C(C=NC1=C(C=CC(=C1)Cl)C(=O)NCC2=CC=CC=C2)NC(=O)O

InChI

InChI=1S/C20H22ClN3O3/c1-13(2)18(24-20(26)27)12-22-17-10-15(21)8-9-16(17)19(25)23-11-14-6-4-3-5-7-14/h3-10,12-13,18,24H,11H2,1-2H3,(H,23,25)(H,26,27)