2-(6-azanylpyridin-3-yl)-3-(ethylamino)-3-methyl-2-oxidanyl-4H-chromene-6-carboxylic acid

Systemtic Name: 2-(6-azanylpyridin-3-yl)-3-(ethylamino)-3-methyl-2-oxidanyl-4H-chromene-6-carboxylic acid Openeye Name: 2-(6-amino-3-pyridyl)-3-(ethylamino)-2-hydroxy-3-methyl-chromane-6-carboxylic acid CAS Name: 2-(6-amino-3-pyridinyl)-3-(ethylamino)-2-hydroxy-3-methyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid IUPAC Name: 2-(6-aminopyridin-3-yl)-3-(ethylamino)-2-hydroxy-3-methyl-4H-chromene-6-carboxylic acid Traditional Name: 2-(6-amino-3-pyridyl)-3-(ethylamino)-2-hydroxy-3-methyl-chroman-6-carboxylic acid Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1(CC2=C(C=CC(=C2)C(=O)O)OC1(C3=CN=C(C=C3)N)O)C

Isomeric SMILES

CCNC1(CC2=C(C=CC(=C2)C(=O)O)OC1(C3=CN=C(C=C3)N)O)C

InChI

InChI=1S/C18H21N3O4/c1-3-21-17(2)9-12-8-11(16(22)23)4-6-14(12)25-18(17,24)13-5-7-15(19)20-10-13/h4-8,10,21,24H,3,9H2,1-2H3,(H2,19,20)(H,22,23)