3-nitro-N-phenethyl-4-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: 3-nitro-N-phenethyl-4-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 4-(4-benzyl-1-piperidyl)-3-nitro-N-phenethyl-benzamide CAS Name: 3-nitro-N-phenethyl-4-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 4-(4-benzylpiperidin-1-yl)-3-nitro-N-phenethylbenzamide Traditional Name: 4-(4-benzylpiperidino)-3-nitro-N-phenethyl-benzamide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)C(=O)NCCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)C(=O)NCCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H29N3O3/c31-27(28-16-13-21-7-3-1-4-8-21)24-11-12-25(26(20-24)30(32)33)29-17-14-23(15-18-29)19-22-9-5-2-6-10-22/h1-12,20,23H,13-19H2,(H,28,31)