3-[2-(5-chloranyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-(2,2-dimethylpropyl)piperazin-2-one

Systemtic Name: 3-[2-(5-chloranyl-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-(2,2-dimethylpropyl)piperazin-2-one Openeye Name: 3-[2-(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-4-(2,2-dimethylpropyl)piperazin-2-one CAS Name: 3-[2-(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-(2,2-dimethylpropyl)-2-piperazinone IUPAC Name: 3-[2-(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-(2,2-dimethylpropyl)piperazin-2-one Traditional Name: 3-[2-(5-chloro-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-4-neopentyl-piperazin-2-one Formula: C20H28ClN3O2 MolecularWeight: 377.90822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCNC(=O)C1CC(=O)N2CCC3=C(C2)C=CC=C3Cl

Isomeric SMILES

CC(C)(C)CN1CCNC(=O)C1CC(=O)N2CCC3=C(C2)C=CC=C3Cl

InChI

InChI=1S/C20H28ClN3O2/c1-20(2,3)13-24-10-8-22-19(26)17(24)11-18(25)23-9-7-15-14(12-23)5-4-6-16(15)21/h4-6,17H,7-13H2,1-3H3,(H,22,26)