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

Systemtic Name: N-[1-(3-methylbutyl)piperidin-4-yl]-N-[[3-(4-oxidanylpent-1-ynyl)phenyl]methyl]-4-pentyl-benzamide Openeye Name: N-[[3-(4-hydroxypent-1-ynyl)phenyl]methyl]-N-(1-isopentyl-4-piperidyl)-4-pentyl-benzamide CAS Name: N-[[3-(4-hydroxypent-1-ynyl)phenyl]methyl]-N-[1-(3-methylbutyl)-4-piperidinyl]-4-pentylbenzamide IUPAC Name: N-[[3-(4-hydroxypent-1-ynyl)phenyl]methyl]-N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentylbenzamide Traditional Name: 4-amyl-N-[3-(4-hydroxypent-1-ynyl)benzyl]-N-(1-isoamyl-4-piperidyl)benzamide Formula: C34H48N2O2 MolecularWeight: 516.75712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H48N2O2/c1-5-6-7-11-29-15-17-32(18-16-29)34(38)36(33-20-23-35(24-21-33)22-19-27(2)3)26-31-14-9-13-30(25-31)12-8-10-28(4)37/h9,13-18,25,27-28,33,37H,5-7,10-11,19-24,26H2,1-4H3