N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)-4-methyl-3-nitro-benzamide

Systemtic Name: N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)-4-methyl-3-nitro-benzamide Openeye Name: N-(3-chloro-2-pyrrolidin-1-yl-phenyl)-4-methyl-3-nitro-benzamide CAS Name: N-[3-chloro-2-(1-pyrrolidinyl)phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-(3-chloro-2-pyrrolidin-1-ylphenyl)-4-methyl-3-nitrobenzamide Traditional Name: N-(3-chloro-2-pyrrolidino-phenyl)-4-methyl-3-nitro-benzamide Formula: C18H18ClN3O3 MolecularWeight: 359.80682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCCC3)[N+](=O)[O-]

InChI

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