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

Systemtic Name: [4-[bis(2-chloroethyl)amino]-3-propan-2-yl-phenyl] (4-nitrophenyl) carbonate Openeye Name: [4-[bis(2-chloroethyl)amino]-3-isopropyl-phenyl] (4-nitrophenyl) carbonate CAS Name: carbonic acid [4-[bis(2-chloroethyl)amino]-3-propan-2-ylphenyl] (4-nitrophenyl) ester IUPAC Name: [4-[bis(2-chloroethyl)amino]-3-propan-2-ylphenyl] (4-nitrophenyl) carbonate Traditional Name: carbonic acid [4-[bis(2-chloroethyl)amino]-3-isopropyl-phenyl] (4-nitrophenyl) ester Formula: C20H22Cl2N2O5 MolecularWeight: 441.30508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22Cl2N2O5/c1-14(2)18-13-17(7-8-19(18)23(11-9-21)12-10-22)29-20(25)28-16-5-3-15(4-6-16)24(26)27/h3-8,13-14H,9-12H2,1-2H3