2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(nonanoylamino)-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(nonanoylamino)-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(nonanoylamino)-N-(3-pyridylmethyl)benzamide CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-(1-oxononylamino)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(nonanoylamino)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-[4-(2-methoxyphenyl)piperazino]-5-(pelargonylamino)-N-(3-pyridylmethyl)benzamide Formula: C33H43N5O3 MolecularWeight: 557.72622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CCCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C33H43N5O3/c1-3-4-5-6-7-8-15-32(39)36-27-16-17-29(28(23-27)33(40)35-25-26-12-11-18-34-24-26)37-19-21-38(22-20-37)30-13-9-10-14-31(30)41-2/h9-14,16-18,23-24H,3-8,15,19-22,25H2,1-2H3,(H,35,40)(H,36,39)