2-[2-[4-[(Z)-2-chloranyl-1,2-diphenyl-ethenyl]phenyl]sulfanyloxy-2-oxidanylidene-ethyl]-2-oxidanyl-butanedioic acid; N,N-diethylethanamine

Systemtic Name: 2-[2-[4-[(Z)-2-chloranyl-1,2-diphenyl-ethenyl]phenyl]sulfanyloxy-2-oxidanylidene-ethyl]-2-oxidanyl-butanedioic acid; N,N-diethylethanamine Openeye Name: 2-[2-[4-[(Z)-2-chloro-1,2-diphenyl-vinyl]phenyl]sulfanyloxy-2-oxo-ethyl]-2-hydroxy-butanedioic acid; N,N-diethylethanamine CAS Name: 2-[2-[[4-[(Z)-2-chloro-1,2-diphenylethenyl]phenyl]thio]oxy-2-oxoethyl]-2-hydroxybutanedioic acid; N,N-diethylethanamine IUPAC Name: 2-[2-[4-[(Z)-2-chloro-1,2-diphenylethenyl]phenyl]sulfanyloxy-2-oxoethyl]-2-hydroxybutanedioic acid; N,N-diethylethanamine Traditional Name: 2-[2-[[4-[(Z)-2-chloro-1,2-diphenyl-vinyl]phenyl]thio]oxy-2-keto-ethyl]-2-hydroxy-succinic acid; triethylamine Formula: C32H36ClNO7S MolecularWeight: 614.14874

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=C(C=C3)SOC(=O)CC(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CC.C1=CC=C(C=C1)/C(=C(\C2=CC=CC=C2)/Cl)/C3=CC=C(C=C3)SOC(=O)CC(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C26H21ClO7S.C6H15N/c27-24(19-9-5-2-6-10-19)23(17-7-3-1-4-8-17)18-11-13-20(14-12-18)35-34-22(30)16-26(33,25(31)32)15-21(28)29;1-4-7(5-2)6-3/h1-14,33H,15-16H2,(H,28,29)(H,31,32);4-6H2,1-3H3/b24-23-;