N-[2-(dimethylaminomethyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-(dimethylaminomethyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(dimethylaminomethyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(dimethylaminomethyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(dimethylaminomethyl)phenyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(dimethylaminomethyl)phenyl]-3-nitro-4-pyrrolidino-benzamide Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O3/c1-22(2)14-16-7-3-4-8-17(16)21-20(25)15-9-10-18(19(13-15)24(26)27)23-11-5-6-12-23/h3-4,7-10,13H,5-6,11-12,14H2,1-2H3,(H,21,25)