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

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-3-(4-methylpiperidin-1-yl)naphthalene-1,4-dione Openeye Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-3-(4-methyl-1-piperidyl)naphthalene-1,4-dione CAS Name: 2-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]-3-(4-methyl-1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-3-(4-methylpiperidin-1-yl)naphthalene-1,4-dione Traditional Name: 2-[4-(4-methoxyphenyl)piperazino]sulfonyl-3-(4-methylpiperidino)-1,4-naphthoquinone Formula: C27H31N3O5S MolecularWeight: 509.61714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N4CCN(CC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)S(=O)(=O)N4CCN(CC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H31N3O5S/c1-19-11-13-29(14-12-19)24-25(31)22-5-3-4-6-23(22)26(32)27(24)36(33,34)30-17-15-28(16-18-30)20-7-9-21(35-2)10-8-20/h3-10,19H,11-18H2,1-2H3