2-[2-(2-azanyl-3-methoxycarbonyl-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)phenoxy]ethanoic acid

Systemtic Name: 2-[2-(2-azanyl-3-methoxycarbonyl-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)phenoxy]ethanoic acid Openeye Name: 2-[2-(2-amino-3-methoxycarbonyl-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)phenoxy]acetic acid CAS Name: 2-[2-(2-amino-3-methoxycarbonyl-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-4-yl)phenoxy]acetic acid IUPAC Name: 2-[2-(2-amino-3-methoxycarbonyl-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)phenoxy]acetic acid Traditional Name: 2-[2-(2-amino-3-carbomethoxy-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-4-yl)phenoxy]acetic acid Formula: C21H23NO7 MolecularWeight: 401.40982

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC=CC=C3OCC(=O)O)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC=CC=C3OCC(=O)O)C(=O)C1)C

InChI

InChI=1S/C21H23NO7/c1-21(2)8-12(23)17-14(9-21)29-19(22)18(20(26)27-3)16(17)11-6-4-5-7-13(11)28-10-15(24)25/h4-7,16H,8-10,22H2,1-3H3,(H,24,25)