3-(1,3-benzodioxol-5-ylcarbonylamino)-N-[1-[2-(3-methoxyphenyl)ethanoyl]piperidin-4-yl]pyrazine-2-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-ylcarbonylamino)-N-[1-[2-(3-methoxyphenyl)ethanoyl]piperidin-4-yl]pyrazine-2-carboxamide Openeye Name: 3-(1,3-benzodioxole-5-carbonylamino)-N-[1-[2-(3-methoxyphenyl)acetyl]-4-piperidyl]pyrazine-2-carboxamide CAS Name: 3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-N-[1-[2-(3-methoxyphenyl)-1-oxoethyl]-4-piperidinyl]-2-pyrazinecarboxamide IUPAC Name: 3-(1,3-benzodioxole-5-carbonylamino)-N-[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]pyrazine-2-carboxamide Traditional Name: N-[1-[2-(3-methoxyphenyl)acetyl]-4-piperidyl]-3-(piperonyloylamino)pyrazinamide Formula: C27H27N5O6 MolecularWeight: 517.53318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC(=O)N2CCC(CC2)NC(=O)C3=NC=CN=C3NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC(=C1)CC(=O)N2CCC(CC2)NC(=O)C3=NC=CN=C3NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H27N5O6/c1-36-20-4-2-3-17(13-20)14-23(33)32-11-7-19(8-12-32)30-27(35)24-25(29-10-9-28-24)31-26(34)18-5-6-21-22(15-18)38-16-37-21/h2-6,9-10,13,15,19H,7-8,11-12,14,16H2,1H3,(H,30,35)(H,29,31,34)