(4Z)-7-butyl-4-(phenylmethylidene)-2-(phenylsulfonyl)-6-propan-2-yloxy-1,3-dihydroisoquinoline-5,8-dione

Systemtic Name: (4Z)-7-butyl-4-(phenylmethylidene)-2-(phenylsulfonyl)-6-propan-2-yloxy-1,3-dihydroisoquinoline-5,8-dione Openeye Name: (4Z)-2-(benzenesulfonyl)-4-benzylidene-7-butyl-6-isopropoxy-1,3-dihydroisoquinoline-5,8-dione CAS Name: (4Z)-2-(benzenesulfonyl)-7-butyl-4-(phenylmethylene)-6-propan-2-yloxy-1,3-dihydroisoquinoline-5,8-dione IUPAC Name: (4Z)-2-(benzenesulfonyl)-4-benzylidene-7-butyl-6-propan-2-yloxy-1,3-dihydroisoquinoline-5,8-dione Traditional Name: (4Z)-4-benzal-2-besyl-7-butyl-6-isopropoxy-1,3-dihydroisoquinoline-5,8-quinone Formula: C29H31NO5S MolecularWeight: 505.62514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)C2=C(C1=O)CN(CC2=CC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)OC(C)C

Isomeric SMILES

CCCCC1=C(C(=O)C\2=C(C1=O)CN(C/C2=C\C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)OC(C)C

InChI

InChI=1S/C29H31NO5S/c1-4-5-16-24-27(31)25-19-30(36(33,34)23-14-10-7-11-15-23)18-22(17-21-12-8-6-9-13-21)26(25)28(32)29(24)35-20(2)3/h6-15,17,20H,4-5,16,18-19H2,1-3H3/b22-17+