3-[bis(2-chloroethyl)amino]-N-(2-dimethylaminoethyl)-2-nitro-benzamide hydrochloride

Systemtic Name: 3-[bis(2-chloroethyl)amino]-N-(2-dimethylaminoethyl)-2-nitro-benzamide hydrochloride Openeye Name: 3-[bis(2-chloroethyl)amino]-N-(2-dimethylaminoethyl)-2-nitro-benzamide hydrochloride CAS Name: 3-[bis(2-chloroethyl)amino]-N-(2-dimethylaminoethyl)-2-nitrobenzamide hydrochloride IUPAC Name: 3-[bis(2-chloroethyl)amino]-N-(2-dimethylaminoethyl)-2-nitrobenzamide hydrochloride Traditional Name: 3-[bis(2-chloroethyl)amino]-N-(2-dimethylaminoethyl)-2-nitro-benzamide hydrochloride Formula: C15H23Cl3N4O3 MolecularWeight: 413.72712

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=C(C(=CC=C1)N(CCCl)CCCl)[N+](=O)[O-].Cl

Isomeric SMILES

CN(C)CCNC(=O)C1=C(C(=CC=C1)N(CCCl)CCCl)[N+](=O)[O-].Cl

InChI

InChI=1S/C15H22Cl2N4O3.ClH/c1-19(2)11-8-18-15(22)12-4-3-5-13(14(12)21(23)24)20(9-6-16)10-7-17;/h3-5H,6-11H2,1-2H3,(H,18,22);1H