N-[[3-(3-methoxyprop-1-ynyl)phenyl]methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-benzamide

Systemtic Name: N-[[3-(3-methoxyprop-1-ynyl)phenyl]methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-benzamide Openeye Name: N-(1-isopentyl-4-piperidyl)-N-[[3-(3-methoxyprop-1-ynyl)phenyl]methyl]-4-pentyl-benzamide CAS Name: N-[[3-(3-methoxyprop-1-ynyl)phenyl]methyl]-N-[1-(3-methylbutyl)-4-piperidinyl]-4-pentylbenzamide IUPAC Name: N-[[3-(3-methoxyprop-1-ynyl)phenyl]methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentylbenzamide Traditional Name: 4-amyl-N-(1-isoamyl-4-piperidyl)-N-[3-(3-methoxyprop-1-ynyl)benzyl]benzamide Formula: C33H46N2O2 MolecularWeight: 502.73054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CC(=C2)C#CCOC)C3CCN(CC3)CCC(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=CC=CC(=C2)C#CCOC)C3CCN(CC3)CCC(C)C

InChI

InChI=1S/C33H46N2O2/c1-5-6-7-10-28-14-16-31(17-15-28)33(36)35(32-19-22-34(23-20-32)21-18-27(2)3)26-30-12-8-11-29(25-30)13-9-24-37-4/h8,11-12,14-17,25,27,32H,5-7,10,18-24,26H2,1-4H3