2-[[azanyl-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-3-methyl-naphthalene-1,4-dione

Systemtic Name: 2-[[azanyl-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-3-methyl-naphthalene-1,4-dione Openeye Name: 2-[[amino-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-3-methyl-naphthalene-1,4-dione CAS Name: 2-[[amino-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-3-methylnaphthalene-1,4-dione IUPAC Name: 2-[[amino-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-3-methylnaphthalene-1,4-dione Traditional Name: 2-[[amino-[bis(2-bromoethyl)amino]phosphoryl]oxymethyl]-3-methyl-1,4-naphthoquinone Formula: C16H19Br2N2O4P MolecularWeight: 494.114821

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2C1=O)COP(=O)(N)N(CCBr)CCBr

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)COP(=O)(N)N(CCBr)CCBr

InChI

InChI=1S/C16H19Br2N2O4P/c1-11-14(10-24-25(19,23)20(8-6-17)9-7-18)16(22)13-5-3-2-4-12(13)15(11)21/h2-5H,6-10H2,1H3,(H2,19,23)