[2-(azocan-1-yl)-2-oxidanylidene-ethyl] (Z)-3-(4-methoxyphenyl)-2-thiophen-2-yl-prop-2-enoate

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl] (Z)-3-(4-methoxyphenyl)-2-thiophen-2-yl-prop-2-enoate Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl] (Z)-3-(4-methoxyphenyl)-2-(2-thienyl)prop-2-enoate CAS Name: (Z)-3-(4-methoxyphenyl)-2-thiophen-2-yl-2-propenoic acid [2-(1-azocanyl)-2-oxoethyl] ester IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl] (Z)-3-(4-methoxyphenyl)-2-thiophen-2-ylprop-2-enoate Traditional Name: (Z)-3-(4-methoxyphenyl)-2-(2-thienyl)acrylic acid [2-(azocan-1-yl)-2-keto-ethyl] ester Formula: C23H27NO4S MolecularWeight: 413.52978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C2=CC=CS2)C(=O)OCC(=O)N3CCCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C2=CC=CS2)/C(=O)OCC(=O)N3CCCCCCC3

InChI

InChI=1S/C23H27NO4S/c1-27-19-11-9-18(10-12-19)16-20(21-8-7-15-29-21)23(26)28-17-22(25)24-13-5-3-2-4-6-14-24/h7-12,15-16H,2-6,13-14,17H2,1H3/b20-16+