4-(4-methylpiperidin-1-yl)-3-nitro-N-phenethyl-benzamide

Systemtic Name: 4-(4-methylpiperidin-1-yl)-3-nitro-N-phenethyl-benzamide Openeye Name: 4-(4-methyl-1-piperidyl)-3-nitro-N-phenethyl-benzamide CAS Name: 4-(4-methyl-1-piperidinyl)-3-nitro-N-phenethylbenzamide IUPAC Name: 4-(4-methylpiperidin-1-yl)-3-nitro-N-phenethylbenzamide Traditional Name: 4-(4-methylpiperidino)-3-nitro-N-phenethyl-benzamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

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