[4-[bis(2-chloroethyl)amino]-3-methyl-phenyl] N-(4-nitrophenyl)carbamate

Systemtic Name: [4-[bis(2-chloroethyl)amino]-3-methyl-phenyl] N-(4-nitrophenyl)carbamate Openeye Name: [4-[bis(2-chloroethyl)amino]-3-methyl-phenyl] N-(4-nitrophenyl)carbamate CAS Name: N-(4-nitrophenyl)carbamic acid [4-[bis(2-chloroethyl)amino]-3-methylphenyl] ester IUPAC Name: [4-[bis(2-chloroethyl)amino]-3-methylphenyl] N-(4-nitrophenyl)carbamate Traditional Name: N-(4-nitrophenyl)carbamic acid [4-[bis(2-chloroethyl)amino]-3-methyl-phenyl] ester Formula: C18H19Cl2N3O4 MolecularWeight: 412.26716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N(CCCl)CCCl

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])N(CCCl)CCCl

InChI

InChI=1S/C18H19Cl2N3O4/c1-13-12-16(6-7-17(13)22(10-8-19)11-9-20)27-18(24)21-14-2-4-15(5-3-14)23(25)26/h2-7,12H,8-11H2,1H3,(H,21,24)