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

Systemtic Name: [4-[bis(2-chloroethyl)amino]-3-methyl-phenyl] (4-nitrophenyl) carbonate Openeye Name: [4-[bis(2-chloroethyl)amino]-3-methyl-phenyl] (4-nitrophenyl) carbonate CAS Name: carbonic acid [4-[bis(2-chloroethyl)amino]-3-methylphenyl] (4-nitrophenyl) ester IUPAC Name: [4-[bis(2-chloroethyl)amino]-3-methylphenyl] (4-nitrophenyl) carbonate Traditional Name: carbonic acid [4-[bis(2-chloroethyl)amino]-3-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)OC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])N(CCCl)CCCl

Isomeric SMILES

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

InChI

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