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

Systemtic Name: 2-(diethylamino)-3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-naphthalene-1,4-dione Openeye Name: 2-(diethylamino)-3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-naphthalene-1,4-dione CAS Name: 2-(diethylamino)-3-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]naphthalene-1,4-dione IUPAC Name: 2-(diethylamino)-3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylnaphthalene-1,4-dione Traditional Name: 2-(diethylamino)-3-[4-(4-methoxyphenyl)piperazino]sulfonyl-1,4-naphthoquinone Formula: C25H29N3O5S MolecularWeight: 483.57986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O5S/c1-4-26(5-2)22-23(29)20-8-6-7-9-21(20)24(30)25(22)34(31,32)28-16-14-27(15-17-28)18-10-12-19(33-3)13-11-18/h6-13H,4-5,14-17H2,1-3H3