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

Systemtic Name: 3-nitro-4-[4-(phenylmethyl)piperidin-1-yl]-N-propyl-benzamide Openeye Name: 4-(4-benzyl-1-piperidyl)-3-nitro-N-propyl-benzamide CAS Name: 3-nitro-4-[4-(phenylmethyl)-1-piperidinyl]-N-propylbenzamide IUPAC Name: 4-(4-benzylpiperidin-1-yl)-3-nitro-N-propylbenzamide Traditional Name: 4-(4-benzylpiperidino)-3-nitro-N-propyl-benzamide Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)C1=CC(=C(C=C1)N2CCC(CC2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O3/c1-2-12-23-22(26)19-8-9-20(21(16-19)25(27)28)24-13-10-18(11-14-24)15-17-6-4-3-5-7-17/h3-9,16,18H,2,10-15H2,1H3,(H,23,26)