[4-[bis(2-chloroethyl)amino]naphthalen-1-yl] (4-nitrophenyl) carbonate

Systemtic Name: [4-[bis(2-chloroethyl)amino]naphthalen-1-yl] (4-nitrophenyl) carbonate Openeye Name: [4-[bis(2-chloroethyl)amino]-1-naphthyl] (4-nitrophenyl) carbonate CAS Name: carbonic acid [4-[bis(2-chloroethyl)amino]-1-naphthalenyl] (4-nitrophenyl) ester IUPAC Name: [4-[bis(2-chloroethyl)amino]naphthalen-1-yl] (4-nitrophenyl) carbonate Traditional Name: carbonic acid [4-[bis(2-chloroethyl)amino]-1-naphthyl] (4-nitrophenyl) ester Formula: C21H18Cl2N2O5 MolecularWeight: 449.28402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2OC(=O)OC3=CC=C(C=C3)[N+](=O)[O-])N(CCCl)CCCl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2OC(=O)OC3=CC=C(C=C3)[N+](=O)[O-])N(CCCl)CCCl

InChI

InChI=1S/C21H18Cl2N2O5/c22-11-13-24(14-12-23)19-9-10-20(18-4-2-1-3-17(18)19)30-21(26)29-16-7-5-15(6-8-16)25(27)28/h1-10H,11-14H2