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

Systemtic Name: 2-(dipropylamino)-3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-naphthalene-1,4-dione Openeye Name: 2-(dipropylamino)-3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-naphthalene-1,4-dione CAS Name: 2-(dipropylamino)-3-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]naphthalene-1,4-dione IUPAC Name: 2-(dipropylamino)-3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylnaphthalene-1,4-dione Traditional Name: 2-(dipropylamino)-3-[4-(4-methoxyphenyl)piperazino]sulfonyl-1,4-naphthoquinone Formula: C27H33N3O5S MolecularWeight: 511.63302

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCN(CCC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H33N3O5S/c1-4-14-29(15-5-2)24-25(31)22-8-6-7-9-23(22)26(32)27(24)36(33,34)30-18-16-28(17-19-30)20-10-12-21(35-3)13-11-20/h6-13H,4-5,14-19H2,1-3H3