3-[bis(2-chloroethyl)amino]-N-(4-methyl-2-nitro-phenyl)benzamide

Systemtic Name: 3-[bis(2-chloroethyl)amino]-N-(4-methyl-2-nitro-phenyl)benzamide Openeye Name: 3-[bis(2-chloroethyl)amino]-N-(4-methyl-2-nitro-phenyl)benzamide CAS Name: 3-[bis(2-chloroethyl)amino]-N-(4-methyl-2-nitrophenyl)benzamide IUPAC Name: 3-[bis(2-chloroethyl)amino]-N-(4-methyl-2-nitrophenyl)benzamide Traditional Name: 3-[bis(2-chloroethyl)amino]-N-(4-methyl-2-nitro-phenyl)benzamide Formula: C18H19Cl2N3O3 MolecularWeight: 396.26776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CC=C2)N(CCCl)CCCl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CC=C2)N(CCCl)CCCl)[N+](=O)[O-]

InChI

InChI=1S/C18H19Cl2N3O3/c1-13-5-6-16(17(11-13)23(25)26)21-18(24)14-3-2-4-15(12-14)22(9-7-19)10-8-20/h2-6,11-12H,7-10H2,1H3,(H,21,24)