[1-(4-bromanyl-1-benzothiophen-3-yl)-2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]phosphonic acid

Systemtic Name: [1-(4-bromanyl-1-benzothiophen-3-yl)-2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]phosphonic acid Openeye Name: [1-(4-bromobenzothiophen-3-yl)-2-(2-naphthylamino)-2-oxo-ethyl]phosphonic acid CAS Name: [1-(4-bromo-1-benzothiophen-3-yl)-2-(2-naphthalenylamino)-2-oxoethyl]phosphonic acid IUPAC Name: [1-(4-bromo-1-benzothiophen-3-yl)-2-(naphthalen-2-ylamino)-2-oxoethyl]phosphonic acid Traditional Name: [1-(4-bromobenzothiophen-3-yl)-2-keto-2-(2-naphthylamino)ethyl]phosphonic acid Formula: C20H15BrNO4PS MolecularWeight: 476.280161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC(=O)C(C3=CSC4=C3C(=CC=C4)Br)P(=O)(O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC(=O)C(C3=CSC4=C3C(=CC=C4)Br)P(=O)(O)O

InChI

InChI=1S/C20H15BrNO4PS/c21-16-6-3-7-17-18(16)15(11-28-17)19(27(24,25)26)20(23)22-14-9-8-12-4-1-2-5-13(12)10-14/h1-11,19H,(H,22,23)(H2,24,25,26)