methyl 2-[[bis(2-chloroethyl)amino-butoxy-phosphoryl]amino]-3-methyl-butanoate

Systemtic Name: methyl 2-[[bis(2-chloroethyl)amino-butoxy-phosphoryl]amino]-3-methyl-butanoate Openeye Name: methyl 2-[[bis(2-chloroethyl)amino-butoxy-phosphoryl]amino]-3-methyl-butanoate CAS Name: 2-[[bis(2-chloroethyl)amino-butoxyphosphoryl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[bis(2-chloroethyl)amino-butoxyphosphoryl]amino]-3-methylbutanoate Traditional Name: 2-[[bis(2-chloroethyl)amino-butoxy-phosphoryl]amino]-3-methyl-butyric acid methyl ester Formula: C14H29Cl2N2O4P MolecularWeight: 391.270821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(NC(C(C)C)C(=O)OC)N(CCCl)CCCl

Isomeric SMILES

CCCCOP(=O)(NC(C(C)C)C(=O)OC)N(CCCl)CCCl

InChI

InChI=1S/C14H29Cl2N2O4P/c1-5-6-11-22-23(20,18(9-7-15)10-8-16)17-13(12(2)3)14(19)21-4/h12-13H,5-11H2,1-4H3,(H,17,20)