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

Systemtic Name: 3-(ethylamino)-3-methyl-2-oxidanyl-2-pyridin-3-yl-4H-chromene-6-carboxylic acid Openeye Name: 3-(ethylamino)-2-hydroxy-3-methyl-2-(3-pyridyl)chromane-6-carboxylic acid CAS Name: 3-(ethylamino)-2-hydroxy-3-methyl-2-(3-pyridinyl)-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid IUPAC Name: 3-(ethylamino)-2-hydroxy-3-methyl-2-pyridin-3-yl-4H-chromene-6-carboxylic acid Traditional Name: 3-(ethylamino)-2-hydroxy-3-methyl-2-(3-pyridyl)chroman-6-carboxylic acid Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O4/c1-3-20-17(2)10-13-9-12(16(21)22)6-7-15(13)24-18(17,23)14-5-4-8-19-11-14/h4-9,11,20,23H,3,10H2,1-2H3,(H,21,22)