[1-(5-chloranyl-1-benzothiophen-3-yl)-2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]-phenethyl-phosphinic acid

Systemtic Name: [1-(5-chloranyl-1-benzothiophen-3-yl)-2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]-phenethyl-phosphinic acid Openeye Name: [1-(5-chlorobenzothiophen-3-yl)-2-(2-naphthylamino)-2-oxo-ethyl]-phenethyl-phosphinic acid CAS Name: [1-(5-chloro-1-benzothiophen-3-yl)-2-(2-naphthalenylamino)-2-oxoethyl]-phenethylphosphinic acid IUPAC Name: [1-(5-chloro-1-benzothiophen-3-yl)-2-(naphthalen-2-ylamino)-2-oxoethyl]-phenethylphosphinic acid Traditional Name: [1-(5-chlorobenzothiophen-3-yl)-2-keto-2-(2-naphthylamino)ethyl]-phenethyl-phosphinic acid Formula: C28H23ClNO3PS MolecularWeight: 519.978881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCP(=O)(C(C2=CSC3=C2C=C(C=C3)Cl)C(=O)NC4=CC5=CC=CC=C5C=C4)O

Isomeric SMILES

C1=CC=C(C=C1)CCP(=O)(C(C2=CSC3=C2C=C(C=C3)Cl)C(=O)NC4=CC5=CC=CC=C5C=C4)O

InChI

InChI=1S/C28H23ClNO3PS/c29-22-11-13-26-24(17-22)25(18-35-26)27(34(32,33)15-14-19-6-2-1-3-7-19)28(31)30-23-12-10-20-8-4-5-9-21(20)16-23/h1-13,16-18,27H,14-15H2,(H,30,31)(H,32,33)