[4-[(4-butoxyphenyl)methyl]piperazin-1-yl]-[1-(pyridin-4-ylmethyl)piperidin-4-yl]methanone

Systemtic Name: [4-[(4-butoxyphenyl)methyl]piperazin-1-yl]-[1-(pyridin-4-ylmethyl)piperidin-4-yl]methanone Openeye Name: [4-[(4-butoxyphenyl)methyl]piperazin-1-yl]-[1-(4-pyridylmethyl)-4-piperidyl]methanone CAS Name: [4-[(4-butoxyphenyl)methyl]-1-piperazinyl]-[1-(pyridin-4-ylmethyl)-4-piperidinyl]methanone IUPAC Name: [4-[(4-butoxyphenyl)methyl]piperazin-1-yl]-[1-(pyridin-4-ylmethyl)piperidin-4-yl]methanone Traditional Name: [4-(4-butoxybenzyl)piperazino]-[1-(4-pyridylmethyl)-4-piperidyl]methanone Formula: C27H38N4O2 MolecularWeight: 450.61622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3CCN(CC3)CC4=CC=NC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3CCN(CC3)CC4=CC=NC=C4

InChI

InChI=1S/C27H38N4O2/c1-2-3-20-33-26-6-4-23(5-7-26)21-30-16-18-31(19-17-30)27(32)25-10-14-29(15-11-25)22-24-8-12-28-13-9-24/h4-9,12-13,25H,2-3,10-11,14-22H2,1H3