2-[[4-[(4-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]-1H-quinolin-4-one

Systemtic Name: 2-[[4-[(4-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]-1H-quinolin-4-one Openeye Name: 2-[[4-[(4-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]-1H-quinolin-4-one CAS Name: 2-[[4-[(4-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)-1-piperazinyl]methyl]-1H-quinolin-4-one IUPAC Name: 2-[[4-[(4-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]-1H-quinolin-4-one Traditional Name: 2-[[4-(4-ethoxybenzyl)-3-(2-hydroxyethyl)piperazino]methyl]-4-quinolone Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCN(CC2CCO)CC3=CC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCN(CC2CCO)CC3=CC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H31N3O3/c1-2-31-22-9-7-19(8-10-22)16-28-13-12-27(18-21(28)11-14-29)17-20-15-25(30)23-5-3-4-6-24(23)26-20/h3-10,15,21,29H,2,11-14,16-18H2,1H3,(H,26,30)