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

Systemtic Name: 3-(ethylamino)-2-(3-methoxyphenyl)-3-methyl-2-oxidanyl-4H-chromene-6-carboxylic acid Openeye Name: 3-(ethylamino)-2-hydroxy-2-(3-methoxyphenyl)-3-methyl-chromane-6-carboxylic acid CAS Name: 3-(ethylamino)-2-hydroxy-2-(3-methoxyphenyl)-3-methyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid IUPAC Name: 3-(ethylamino)-2-hydroxy-2-(3-methoxyphenyl)-3-methyl-4H-chromene-6-carboxylic acid Traditional Name: 3-(ethylamino)-2-hydroxy-2-(3-methoxyphenyl)-3-methyl-chroman-6-carboxylic acid Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO5/c1-4-21-19(2)12-14-10-13(18(22)23)8-9-17(14)26-20(19,24)15-6-5-7-16(11-15)25-3/h5-11,21,24H,4,12H2,1-3H3,(H,22,23)