2-[[3-(2-hydroxyethyl)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperazin-1-yl]methyl]-1H-quinolin-4-one

Systemtic Name: 2-[[3-(2-hydroxyethyl)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperazin-1-yl]methyl]-1H-quinolin-4-one Openeye Name: 2-[[3-(2-hydroxyethyl)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]piperazin-1-yl]methyl]-1H-quinolin-4-one CAS Name: 2-[[3-(2-hydroxyethyl)-4-[(4-methoxy-2,3-dimethylphenyl)methyl]-1-piperazinyl]methyl]-1H-quinolin-4-one IUPAC Name: 2-[[3-(2-hydroxyethyl)-4-[(4-methoxy-2,3-dimethylphenyl)methyl]piperazin-1-yl]methyl]-1H-quinolin-4-one Traditional Name: 2-[[3-(2-hydroxyethyl)-4-(4-methoxy-2,3-dimethyl-benzyl)piperazino]methyl]-4-quinolone Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OC)CN2CCN(CC2CCO)CC3=CC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C=CC(=C1C)OC)CN2CCN(CC2CCO)CC3=CC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C26H33N3O3/c1-18-19(2)26(32-3)9-8-20(18)15-29-12-11-28(17-22(29)10-13-30)16-21-14-25(31)23-6-4-5-7-24(23)27-21/h4-9,14,22,30H,10-13,15-17H2,1-3H3,(H,27,31)