(E)-3-(4-ethoxy-3-methoxy-phenyl)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-ethoxy-3-methoxy-phenyl)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(4-ethoxy-3-methoxy-phenyl)-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-ethoxy-3-methoxyphenyl)-1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-ethoxy-3-methoxyphenyl)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(4-ethoxy-3-methoxy-phenyl)-1-[4-(2-naphthylsulfonyl)piperazino]prop-2-en-1-one Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O5S/c1-3-33-24-12-8-20(18-25(24)32-2)9-13-26(29)27-14-16-28(17-15-27)34(30,31)23-11-10-21-6-4-5-7-22(21)19-23/h4-13,18-19H,3,14-17H2,1-2H3/b13-9+