N-[4-[4-(2,4-dimethoxyphenyl)piperazin-1-yl]carbonylpiperidin-4-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[4-[4-(2,4-dimethoxyphenyl)piperazin-1-yl]carbonylpiperidin-4-yl]quinoxaline-2-carboxamide Openeye Name: N-[4-[4-(2,4-dimethoxyphenyl)piperazine-1-carbonyl]-4-piperidyl]quinoxaline-2-carboxamide CAS Name: N-[4-[[4-(2,4-dimethoxyphenyl)-1-piperazinyl]-oxomethyl]-4-piperidinyl]-2-quinoxalinecarboxamide IUPAC Name: N-[4-[4-(2,4-dimethoxyphenyl)piperazine-1-carbonyl]piperidin-4-yl]quinoxaline-2-carboxamide Traditional Name: N-[4-[4-(2,4-dimethoxyphenyl)piperazine-1-carbonyl]-4-piperidyl]quinoxaline-2-carboxamide Formula: C27H32N6O4 MolecularWeight: 504.58078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3(CCNCC3)NC(=O)C4=NC5=CC=CC=C5N=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3(CCNCC3)NC(=O)C4=NC5=CC=CC=C5N=C4)OC

InChI

InChI=1S/C27H32N6O4/c1-36-19-7-8-23(24(17-19)37-2)32-13-15-33(16-14-32)26(35)27(9-11-28-12-10-27)31-25(34)22-18-29-20-5-3-4-6-21(20)30-22/h3-8,17-18,28H,9-16H2,1-2H3,(H,31,34)