(2,3-dimethylquinoxalin-6-yl)-[3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]methanone

Systemtic Name: (2,3-dimethylquinoxalin-6-yl)-[3-(hydroxymethyl)-3-phenethyl-piperidin-1-yl]methanone Openeye Name: (2,3-dimethylquinoxalin-6-yl)-[3-(hydroxymethyl)-3-phenethyl-1-piperidyl]methanone CAS Name: (2,3-dimethyl-6-quinoxalinyl)-[3-(hydroxymethyl)-3-phenethyl-1-piperidinyl]methanone IUPAC Name: (2,3-dimethylquinoxalin-6-yl)-[3-(hydroxymethyl)-3-phenethylpiperidin-1-yl]methanone Traditional Name: (2,3-dimethylquinoxalin-6-yl)-(3-methylol-3-phenethyl-piperidino)methanone Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)C(=O)N3CCCC(C3)(CCC4=CC=CC=C4)CO)N=C1C

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)C(=O)N3CCCC(C3)(CCC4=CC=CC=C4)CO)N=C1C

InChI

InChI=1S/C25H29N3O2/c1-18-19(2)27-23-15-21(9-10-22(23)26-18)24(30)28-14-6-12-25(16-28,17-29)13-11-20-7-4-3-5-8-20/h3-5,7-10,15,29H,6,11-14,16-17H2,1-2H3