2-[bis[2-chloroethyl(methyl)amino]phosphoryloxymethyl]naphthalene-1,4-dione

Systemtic Name: 2-[bis[2-chloroethyl(methyl)amino]phosphoryloxymethyl]naphthalene-1,4-dione Openeye Name: 2-[bis[2-chloroethyl(methyl)amino]phosphoryloxymethyl]naphthalene-1,4-dione CAS Name: 2-[bis[2-chloroethyl(methyl)amino]phosphoryloxymethyl]naphthalene-1,4-dione IUPAC Name: 2-[bis[2-chloroethyl(methyl)amino]phosphoryloxymethyl]naphthalene-1,4-dione Traditional Name: 2-[bis[2-chloroethyl(methyl)amino]phosphoryloxymethyl]-1,4-naphthoquinone Formula: C17H21Cl2N2O4P MolecularWeight: 419.239401

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCl)P(=O)(N(C)CCCl)OCC1=CC(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CN(CCCl)P(=O)(N(C)CCCl)OCC1=CC(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C17H21Cl2N2O4P/c1-20(9-7-18)26(24,21(2)10-8-19)25-12-13-11-16(22)14-5-3-4-6-15(14)17(13)23/h3-6,11H,7-10,12H2,1-2H3