2-[[bis(3-methoxythiophen-2-yl)-phosphono-methyl]-phenylmethoxycarbonyl-amino]butanoic acid

Systemtic Name: 2-[[bis(3-methoxythiophen-2-yl)-phosphono-methyl]-phenylmethoxycarbonyl-amino]butanoic acid Openeye Name: 2-[benzyloxycarbonyl-[bis(3-methoxy-2-thienyl)-phosphono-methyl]amino]butanoic acid CAS Name: 2-[[bis(3-methoxy-2-thiophenyl)-phosphonomethyl]-phenylmethoxycarbonylamino]butanoic acid IUPAC Name: 2-[[bis(3-methoxythiophen-2-yl)-phosphonomethyl]-phenylmethoxycarbonylamino]butanoic acid Traditional Name: 2-[[bis(3-methoxy-2-thienyl)-phosphono-methyl]-carbobenzoxy-amino]butyric acid Formula: C23H26NO9PS2 MolecularWeight: 555.557601

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N(C(=O)OCC1=CC=CC=C1)C(C2=C(C=CS2)OC)(C3=C(C=CS3)OC)P(=O)(O)O

Isomeric SMILES

CCC(C(=O)O)N(C(=O)OCC1=CC=CC=C1)C(C2=C(C=CS2)OC)(C3=C(C=CS3)OC)P(=O)(O)O

InChI

InChI=1S/C23H26NO9PS2/c1-4-16(21(25)26)24(22(27)33-14-15-8-6-5-7-9-15)23(34(28,29)30,19-17(31-2)10-12-35-19)20-18(32-3)11-13-36-20/h5-13,16H,4,14H2,1-3H3,(H,25,26)(H2,28,29,30)