N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-N-[(3-pent-1-ynylphenyl)methyl]benzamide

Systemtic Name: N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-N-[(3-pent-1-ynylphenyl)methyl]benzamide Openeye Name: N-(1-isopentyl-4-piperidyl)-4-pentyl-N-[(3-pent-1-ynylphenyl)methyl]benzamide CAS Name: N-[1-(3-methylbutyl)-4-piperidinyl]-4-pentyl-N-[(3-pent-1-ynylphenyl)methyl]benzamide IUPAC Name: N-[1-(3-methylbutyl)piperidin-4-yl]-4-pentyl-N-[(3-pent-1-ynylphenyl)methyl]benzamide Traditional Name: 4-amyl-N-(1-isoamyl-4-piperidyl)-N-(3-pent-1-ynylbenzyl)benzamide Formula: C34H48N2O MolecularWeight: 500.75772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H48N2O/c1-5-7-9-12-29-16-18-32(19-17-29)34(37)36(33-21-24-35(25-22-33)23-20-28(3)4)27-31-15-11-14-30(26-31)13-10-8-6-2/h11,14-19,26,28,33H,5-9,12,20-25,27H2,1-4H3