1-(4-ethoxyphenyl)-4-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)butane-1,4-dione

Systemtic Name: 1-(4-ethoxyphenyl)-4-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)butane-1,4-dione Openeye Name: 1-(4-ethoxyphenyl)-4-[4-(2-naphthylsulfonyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-ethoxyphenyl)-4-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-ethoxyphenyl)-4-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)butane-1,4-dione Traditional Name: 1-[4-(2-naphthylsulfonyl)piperazino]-4-p-phenetyl-butane-1,4-dione Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H28N2O5S/c1-2-33-23-10-7-21(8-11-23)25(29)13-14-26(30)27-15-17-28(18-16-27)34(31,32)24-12-9-20-5-3-4-6-22(20)19-24/h3-12,19H,2,13-18H2,1H3