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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-morpholin-4-yl-naphthalene-1,4-dione Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-morpholino-naphthalene-1,4-dione CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-(4-morpholinyl)naphthalene-1,4-dione IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-morpholin-4-ylnaphthalene-1,4-dione Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-3-morpholino-1,4-naphthoquinone Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C(=O)C4=CC=CC=C4C3=O)N5CCOCC5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C(=O)C4=CC=CC=C4C3=O)N5CCOCC5

InChI

InChI=1S/C23H22N2O5S/c26-21-18-7-3-4-8-19(18)22(27)23(20(21)24-11-13-30-14-12-24)31(28,29)25-10-9-16-5-1-2-6-17(16)15-25/h1-8H,9-15H2