3-nitro-N-(4-phenylbutan-2-yl)-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-(4-phenylbutan-2-yl)-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(1-methyl-3-phenyl-propyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: 3-nitro-N-(4-phenylbutan-2-yl)-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-nitro-N-(4-phenylbutan-2-yl)-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(1-methyl-3-phenyl-propyl)-3-nitro-4-pyrrolidino-benzamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-16(9-10-17-7-3-2-4-8-17)22-21(25)18-11-12-19(20(15-18)24(26)27)23-13-5-6-14-23/h2-4,7-8,11-12,15-16H,5-6,9-10,13-14H2,1H3,(H,22,25)