3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-[(2-ethoxyphenyl)methyl]piperazin-2-one

Systemtic Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-[(2-ethoxyphenyl)methyl]piperazin-2-one Openeye Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-4-[(2-ethoxyphenyl)methyl]piperazin-2-one CAS Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-[(2-ethoxyphenyl)methyl]-2-piperazinone IUPAC Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-[(2-ethoxyphenyl)methyl]piperazin-2-one Traditional Name: 3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-4-(2-ethoxybenzyl)piperazin-2-one Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCNC(=O)C2CC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCNC(=O)C2CC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H29N3O3/c1-2-30-22-10-6-5-9-20(22)17-26-14-12-25-24(29)21(26)15-23(28)27-13-11-18-7-3-4-8-19(18)16-27/h3-10,21H,2,11-17H2,1H3,(H,25,29)