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

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]sulfonyl-3-morpholin-4-yl-naphthalene-1,4-dione Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)sulfonyl-3-morpholino-naphthalene-1,4-dione CAS Name: 2-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]-3-(4-morpholinyl)naphthalene-1,4-dione IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)sulfonyl-3-morpholin-4-ylnaphthalene-1,4-dione Traditional Name: 2-(4-benzhydrylpiperazino)sulfonyl-3-morpholino-1,4-naphthoquinone Formula: C31H31N3O5S MolecularWeight: 557.65994

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=C(C(=O)C5=CC=CC=C5C4=O)N6CCOCC6

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=C(C(=O)C5=CC=CC=C5C4=O)N6CCOCC6

InChI

InChI=1S/C31H31N3O5S/c35-29-25-13-7-8-14-26(25)30(36)31(28(29)33-19-21-39-22-20-33)40(37,38)34-17-15-32(16-18-34)27(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-14,27H,15-22H2