[2-[(6-bromanylnaphthalen-2-yl)amino]-1-(5-chloranyl-1-benzothiophen-3-yl)-2-oxidanylidene-ethyl]phosphonic acid

Systemtic Name: [2-[(6-bromanylnaphthalen-2-yl)amino]-1-(5-chloranyl-1-benzothiophen-3-yl)-2-oxidanylidene-ethyl]phosphonic acid Openeye Name: [2-[(6-bromo-2-naphthyl)amino]-1-(5-chlorobenzothiophen-3-yl)-2-oxo-ethyl]phosphonic acid CAS Name: [2-[(6-bromo-2-naphthalenyl)amino]-1-(5-chloro-1-benzothiophen-3-yl)-2-oxoethyl]phosphonic acid IUPAC Name: [2-[(6-bromonaphthalen-2-yl)amino]-1-(5-chloro-1-benzothiophen-3-yl)-2-oxoethyl]phosphonic acid Traditional Name: [2-[(6-bromo-2-naphthyl)amino]-1-(5-chlorobenzothiophen-3-yl)-2-keto-ethyl]phosphonic acid Formula: C20H14BrClNO4PS MolecularWeight: 510.725221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)Br)C=C1NC(=O)C(C3=CSC4=C3C=C(C=C4)Cl)P(=O)(O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2)Br)C=C1NC(=O)C(C3=CSC4=C3C=C(C=C4)Cl)P(=O)(O)O

InChI

InChI=1S/C20H14BrClNO4PS/c21-13-3-1-12-8-15(5-2-11(12)7-13)23-20(24)19(28(25,26)27)17-10-29-18-6-4-14(22)9-16(17)18/h1-10,19H,(H,23,24)(H2,25,26,27)