2-[[5-[(4-hexoxyphenyl)carbamoyl]-3-methoxy-pyridin-2-yl]oxycarbonylamino]ethanoic acid

Systemtic Name: 2-[[5-[(4-hexoxyphenyl)carbamoyl]-3-methoxy-pyridin-2-yl]oxycarbonylamino]ethanoic acid Openeye Name: 2-[[5-[(4-hexoxyphenyl)carbamoyl]-3-methoxy-2-pyridyl]oxycarbonylamino]acetic acid CAS Name: 2-[[[5-[(4-hexoxyanilino)-oxomethyl]-3-methoxy-2-pyridinyl]oxy-oxomethyl]amino]acetic acid IUPAC Name: 2-[[5-[(4-hexoxyphenyl)carbamoyl]-3-methoxypyridin-2-yl]oxycarbonylamino]acetic acid Traditional Name: 2-[[5-[(4-hexoxyphenyl)carbamoyl]-3-methoxy-2-pyridyl]oxycarbonylamino]acetic acid Formula: C22H27N3O7 MolecularWeight: 445.46568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=O)C2=CC(=C(N=C2)OC(=O)NCC(=O)O)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=O)C2=CC(=C(N=C2)OC(=O)NCC(=O)O)OC

InChI

InChI=1S/C22H27N3O7/c1-3-4-5-6-11-31-17-9-7-16(8-10-17)25-20(28)15-12-18(30-2)21(23-13-15)32-22(29)24-14-19(26)27/h7-10,12-13H,3-6,11,14H2,1-2H3,(H,24,29)(H,25,28)(H,26,27)