2-[3-[6-[methoxy(methyl)carbamoyl]naphthalen-2-yl]propanoylamino]benzoic acid

Systemtic Name: 2-[3-[6-[methoxy(methyl)carbamoyl]naphthalen-2-yl]propanoylamino]benzoic acid Openeye Name: 2-[3-[6-[methoxy(methyl)carbamoyl]-2-naphthyl]propanoylamino]benzoic acid CAS Name: 2-[[3-[6-[[methoxy(methyl)amino]-oxomethyl]-2-naphthalenyl]-1-oxopropyl]amino]benzoic acid IUPAC Name: 2-[3-[6-[methoxy(methyl)carbamoyl]naphthalen-2-yl]propanoylamino]benzoic acid Traditional Name: 2-[3-[6-[methoxy(methyl)carbamoyl]-2-naphthyl]propanoylamino]benzoic acid Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C1=CC2=C(C=C1)C=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)O)OC

Isomeric SMILES

CN(C(=O)C1=CC2=C(C=C1)C=C(C=C2)CCC(=O)NC3=CC=CC=C3C(=O)O)OC

InChI

InChI=1S/C23H22N2O5/c1-25(30-2)22(27)18-11-10-16-13-15(7-9-17(16)14-18)8-12-21(26)24-20-6-4-3-5-19(20)23(28)29/h3-7,9-11,13-14H,8,12H2,1-2H3,(H,24,26)(H,28,29)