ethyl (4S)-2-azanyl-5-oxidanylidene-4-(3-phenoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carboxylate

Systemtic Name: ethyl (4S)-2-azanyl-5-oxidanylidene-4-(3-phenoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: ethyl (4S)-2-amino-5-oxo-4-(3-phenoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: (4S)-2-amino-5-oxo-4-(3-phenoxyphenyl)-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-2-amino-5-oxo-4-(3-phenoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: (4S)-2-amino-5-keto-4-(3-phenoxyphenyl)-4,6,7,8-tetrahydrochromene-3-carboxylic acid ethyl ester Formula: C24H23NO5 MolecularWeight: 405.44312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)CCC2)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C([C@@H]1C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)CCC2)N

InChI

InChI=1S/C24H23NO5/c1-2-28-24(27)22-20(21-18(26)12-7-13-19(21)30-23(22)25)15-8-6-11-17(14-15)29-16-9-4-3-5-10-16/h3-6,8-11,14,20H,2,7,12-13,25H2,1H3/t20-/m0/s1