2-[3-[6-(prop-2-ynoxycarbonylamino)naphthalen-2-yl]propanoylamino]benzoic acid

Systemtic Name: 2-[3-[6-(prop-2-ynoxycarbonylamino)naphthalen-2-yl]propanoylamino]benzoic acid Openeye Name: 2-[3-[6-(prop-2-ynoxycarbonylamino)-2-naphthyl]propanoylamino]benzoic acid CAS Name: 2-[[1-oxo-3-[6-[[oxo(prop-2-ynoxy)methyl]amino]-2-naphthalenyl]propyl]amino]benzoic acid IUPAC Name: 2-[3-[6-(prop-2-ynoxycarbonylamino)naphthalen-2-yl]propanoylamino]benzoic acid Traditional Name: 2-[3-[6-(propargyloxycarbonylamino)-2-naphthyl]propanoylamino]benzoic acid Formula: C24H20N2O5 MolecularWeight: 416.426

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)NC1=CC2=C(C=C1)C=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

C#CCOC(=O)NC1=CC2=C(C=C1)C=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C24H20N2O5/c1-2-13-31-24(30)25-19-11-10-17-14-16(7-9-18(17)15-19)8-12-22(27)26-21-6-4-3-5-20(21)23(28)29/h1,3-7,9-11,14-15H,8,12-13H2,(H,25,30)(H,26,27)(H,28,29)