2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-piperidin-1-yl-naphthalene-1,4-dione

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-piperidino-1,4-naphthoquinone Formula: C24H24N2O4S MolecularWeight: 436.52336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C24H24N2O4S/c27-22-19-10-4-5-11-20(19)23(28)24(21(22)25-13-6-1-7-14-25)31(29,30)26-15-12-17-8-2-3-9-18(17)16-26/h2-5,8-11H,1,6-7,12-16H2