3-[3-(aminomethyl)phenyl]-5-[1-(2,6-dimethylpiperidin-1-yl)pentyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[3-(aminomethyl)phenyl]-5-[1-(2,6-dimethylpiperidin-1-yl)pentyl]-1H-quinoxalin-2-one Openeye Name: 3-[3-(aminomethyl)phenyl]-5-[1-(2,6-dimethyl-1-piperidyl)pentyl]-1H-quinoxalin-2-one CAS Name: 3-[3-(aminomethyl)phenyl]-5-[1-(2,6-dimethyl-1-piperidinyl)pentyl]-1H-quinoxalin-2-one IUPAC Name: 3-[3-(aminomethyl)phenyl]-5-[1-(2,6-dimethylpiperidin-1-yl)pentyl]-1H-quinoxalin-2-one Traditional Name: 3-[3-(aminomethyl)phenyl]-5-[1-(2,6-dimethylpiperidino)pentyl]-1H-quinoxalin-2-one Formula: C27H36N4O MolecularWeight: 432.60094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C2C(=CC=C1)NC(=O)C(=N2)C3=CC(=CC=C3)CN)N4C(CCCC4C)C

Isomeric SMILES

CCCCC(C1=C2C(=CC=C1)NC(=O)C(=N2)C3=CC(=CC=C3)CN)N4C(CCCC4C)C

InChI

InChI=1S/C27H36N4O/c1-4-5-15-24(31-18(2)9-6-10-19(31)3)22-13-8-14-23-26(22)30-25(27(32)29-23)21-12-7-11-20(16-21)17-28/h7-8,11-14,16,18-19,24H,4-6,9-10,15,17,28H2,1-3H3,(H,29,32)