N-(3-chloranyl-2-methyl-phenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-(3-chloro-2-methylphenyl)-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3-chloro-2-methylphenyl)-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-5-nitro-2-pyrrolidino-benzamide Formula: C18H18ClN3O3 MolecularWeight: 359.80682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C18H18ClN3O3/c1-12-15(19)5-4-6-16(12)20-18(23)14-11-13(22(24)25)7-8-17(14)21-9-2-3-10-21/h4-8,11H,2-3,9-10H2,1H3,(H,20,23)