[3-(2-methylpropoxycarbonylamino)phenyl] N-(2-bromoethyl)-N-(3-chlorophenyl)carbamate

Systemtic Name: [3-(2-methylpropoxycarbonylamino)phenyl] N-(2-bromoethyl)-N-(3-chlorophenyl)carbamate Openeye Name: [3-(isobutoxycarbonylamino)phenyl] N-(2-bromoethyl)-N-(3-chlorophenyl)carbamate CAS Name: N-(2-bromoethyl)-N-(3-chlorophenyl)carbamic acid [3-[[2-methylpropoxy(oxo)methyl]amino]phenyl] ester IUPAC Name: [3-(2-methylpropoxycarbonylamino)phenyl] N-(2-bromoethyl)-N-(3-chlorophenyl)carbamate Traditional Name: N-(2-bromoethyl)-N-(3-chlorophenyl)carbamic acid [3-(isobutoxycarbonylamino)phenyl] ester Formula: C20H22BrClN2O4 MolecularWeight: 469.75668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)NC1=CC(=CC=C1)OC(=O)N(CCBr)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)COC(=O)NC1=CC(=CC=C1)OC(=O)N(CCBr)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C20H22BrClN2O4/c1-14(2)13-27-19(25)23-16-6-4-8-18(12-16)28-20(26)24(10-9-21)17-7-3-5-15(22)11-17/h3-8,11-12,14H,9-10,13H2,1-2H3,(H,23,25)