3-(4-ethylphenyl)-1-[[4-(phenylmethyl)piperidin-1-yl]methyl]quinoxalin-2-one

Systemtic Name: 3-(4-ethylphenyl)-1-[[4-(phenylmethyl)piperidin-1-yl]methyl]quinoxalin-2-one Openeye Name: 1-[(4-benzyl-1-piperidyl)methyl]-3-(4-ethylphenyl)quinoxalin-2-one CAS Name: 3-(4-ethylphenyl)-1-[[4-(phenylmethyl)-1-piperidinyl]methyl]-2-quinoxalinone IUPAC Name: 1-[(4-benzylpiperidin-1-yl)methyl]-3-(4-ethylphenyl)quinoxalin-2-one Traditional Name: 1-[(4-benzylpiperidino)methyl]-3-(4-ethylphenyl)quinoxalin-2-one Formula: C29H31N3O MolecularWeight: 437.57594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3N(C2=O)CN4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3N(C2=O)CN4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H31N3O/c1-2-22-12-14-25(15-13-22)28-29(33)32(27-11-7-6-10-26(27)30-28)21-31-18-16-24(17-19-31)20-23-8-4-3-5-9-23/h3-15,24H,2,16-21H2,1H3