4-chloranyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-2-nitro-benzamide

Systemtic Name: 4-chloranyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-2-nitro-benzamide Openeye Name: 4-chloro-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-2-nitro-benzamide CAS Name: 4-chloro-N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-2-nitrobenzamide IUPAC Name: 4-chloro-N-(2-methyl-4-pyrrolidin-1-ylphenyl)-2-nitrobenzamide Traditional Name: 4-chloro-N-(2-methyl-4-pyrrolidino-phenyl)-2-nitro-benzamide Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

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