methyl (4S)-2-azanyl-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate

Systemtic Name: methyl (4S)-2-azanyl-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromene-3-carboxylate Openeye Name: methyl (4S)-2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate CAS Name: (4S)-2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromene-3-carboxylate Traditional Name: (4S)-2-amino-4-(3,4-dimethoxyphenyl)-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromene-3-carboxylic acid methyl ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1(CC2=C([C@@H](C(=C(O2)N)C(=O)OC)C3=CC(=C(C=C3)OC)OC)C(=O)C1)C

InChI

InChI=1S/C21H25NO6/c1-21(2)9-12(23)17-15(10-21)28-19(22)18(20(24)27-5)16(17)11-6-7-13(25-3)14(8-11)26-4/h6-8,16H,9-10,22H2,1-5H3/t16-/m0/s1