[4-[bis(2-chloroethyl)amino]-2-methyl-phenyl] (4-nitrophenyl) carbonate

Systemtic Name: [4-[bis(2-chloroethyl)amino]-2-methyl-phenyl] (4-nitrophenyl) carbonate Openeye Name: [4-[bis(2-chloroethyl)amino]-2-methyl-phenyl] (4-nitrophenyl) carbonate CAS Name: carbonic acid [4-[bis(2-chloroethyl)amino]-2-methylphenyl] (4-nitrophenyl) ester IUPAC Name: [4-[bis(2-chloroethyl)amino]-2-methylphenyl] (4-nitrophenyl) carbonate Traditional Name: carbonic acid [4-[bis(2-chloroethyl)amino]-2-methyl-phenyl] (4-nitrophenyl) ester Formula: C18H18Cl2N2O5 MolecularWeight: 413.25192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CCCl)CCCl)OC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)N(CCCl)CCCl)OC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18Cl2N2O5/c1-13-12-15(21(10-8-19)11-9-20)4-7-17(13)27-18(23)26-16-5-2-14(3-6-16)22(24)25/h2-7,12H,8-11H2,1H3