[4,6,7-trimethyl-2-[2-(2-methyl-3-oxidanyl-4-oxidanylidene-pyridin-1-yl)ethyl]-2,3-dihydro-1-benzofuran-5-yl] 4-azanylbenzoate

Systemtic Name: [4,6,7-trimethyl-2-[2-(2-methyl-3-oxidanyl-4-oxidanylidene-pyridin-1-yl)ethyl]-2,3-dihydro-1-benzofuran-5-yl] 4-azanylbenzoate Openeye Name: [2-[2-(3-hydroxy-2-methyl-4-oxo-1-pyridyl)ethyl]-4,6,7-trimethyl-2,3-dihydrobenzofuran-5-yl] 4-aminobenzoate CAS Name: 4-aminobenzoic acid [2-[2-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)ethyl]-4,6,7-trimethyl-2,3-dihydrobenzofuran-5-yl] ester IUPAC Name: [2-[2-(3-hydroxy-2-methyl-4-oxopyridin-1-yl)ethyl]-4,6,7-trimethyl-2,3-dihydro-1-benzofuran-5-yl] 4-aminobenzoate Traditional Name: 4-aminobenzoic acid [2-[2-(3-hydroxy-4-keto-2-methyl-1-pyridyl)ethyl]-4,6,7-trimethyl-coumaran-5-yl] ester Formula: C26H28N2O5 MolecularWeight: 448.51092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)OC(=O)C3=CC=C(C=C3)N)C)CC(O2)CCN4C=CC(=O)C(=C4C)O

Isomeric SMILES

CC1=C2C(=C(C(=C1C)OC(=O)C3=CC=C(C=C3)N)C)CC(O2)CCN4C=CC(=O)C(=C4C)O

InChI

InChI=1S/C26H28N2O5/c1-14-15(2)25-21(16(3)24(14)33-26(31)18-5-7-19(27)8-6-18)13-20(32-25)9-11-28-12-10-22(29)23(30)17(28)4/h5-8,10,12,20,30H,9,11,13,27H2,1-4H3