N,N-bis(2-chloroethyl)-[4-(phenylmethyl)piperazin-1-yl]phosphonamidic acid

Systemtic Name: N,N-bis(2-chloroethyl)-[4-(phenylmethyl)piperazin-1-yl]phosphonamidic acid Openeye Name: (4-benzylpiperazin-1-yl)-N,N-bis(2-chloroethyl)phosphonamidic acid CAS Name: N,N-bis(2-chloroethyl)-[4-(phenylmethyl)-1-piperazinyl]phosphonamidic acid IUPAC Name: (4-benzylpiperazin-1-yl)-N,N-bis(2-chloroethyl)phosphonamidic acid Traditional Name: (4-benzylpiperazino)-N,N-bis(2-chloroethyl)phosphonamidic acid Formula: C15H24Cl2N3O2P MolecularWeight: 380.249721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)P(=O)(N(CCCl)CCCl)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)P(=O)(N(CCCl)CCCl)O

InChI

InChI=1S/C15H24Cl2N3O2P/c16-6-8-19(9-7-17)23(21,22)20-12-10-18(11-13-20)14-15-4-2-1-3-5-15/h1-5H,6-14H2,(H,21,22)