chloranylcopper(1+); (E)-ethoxy-[2-[(Z)-3-oxidanylidene-1-phenyl-but-1-enyl]imino-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene]methanolate

Systemtic Name: chloranylcopper(1+); (E)-ethoxy-[2-[(Z)-3-oxidanylidene-1-phenyl-but-1-enyl]imino-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene]methanolate Openeye Name: chlorocopper(1+); (E)-ethoxy-[2-[(Z)-3-oxo-1-phenyl-but-1-enyl]imino-4,5,6,7-tetrahydrobenzothiophen-3-ylidene]methanolate CAS Name: chlorocopper(1+); (E)-ethoxy-[2-[(Z)-3-oxo-1-phenylbut-1-enyl]imino-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene]methanolate IUPAC Name: chlorocopper(1+); (E)-ethoxy-[2-[(Z)-3-oxo-1-phenylbut-1-enyl]imino-4,5,6,7-tetrahydro-1-benzothiophen-3-ylidene]methanolate Traditional Name: chlorocopper(1+); (E)-ethoxy-[2-[(Z)-3-keto-1-phenyl-but-1-enyl]imino-4,5,6,7-tetrahydrobenzothiophen-3-ylidene]methanolate Formula: C21H22ClCuNO3S MolecularWeight: 467.46828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C1C2=C(CCCC2)SC1=NC(=CC(=O)C)C3=CC=CC=C3)[O-].Cl[Cu+]

Isomeric SMILES

CCO/C(=C/1\C2=C(CCCC2)SC1=N/C(=C\C(=O)C)/C3=CC=CC=C3)/[O-].Cl[Cu+]

InChI

InChI=1S/C21H23NO3S.ClH.Cu/c1-3-25-21(24)19-16-11-7-8-12-18(16)26-20(19)22-17(13-14(2)23)15-9-5-4-6-10-15;;/h4-6,9-10,13,24H,3,7-8,11-12H2,1-2H3;1H;/q;;+2/p-2/b17-13-,21-19+,22-20?;;