2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-3-morpholin-4-yl-naphthalene-1,4-dione

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-3-morpholin-4-yl-naphthalene-1,4-dione Openeye Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-3-morpholino-naphthalene-1,4-dione CAS Name: 2-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]-3-(4-morpholinyl)naphthalene-1,4-dione IUPAC Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-3-morpholin-4-ylnaphthalene-1,4-dione Traditional Name: 2-[4-(4-methoxyphenyl)piperazino]sulfonyl-3-morpholino-1,4-naphthoquinone Formula: C25H27N3O6S MolecularWeight: 497.56338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=C(C(=O)C4=CC=CC=C4C3=O)N5CCOCC5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=C(C(=O)C4=CC=CC=C4C3=O)N5CCOCC5

InChI

InChI=1S/C25H27N3O6S/c1-33-19-8-6-18(7-9-19)26-10-12-28(13-11-26)35(31,32)25-22(27-14-16-34-17-15-27)23(29)20-4-2-3-5-21(20)24(25)30/h2-9H,10-17H2,1H3