ethyl (4S)-2-azanyl-4-(4-chlorophenyl)-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carboxylate

Systemtic Name: ethyl (4S)-2-azanyl-4-(4-chlorophenyl)-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carboxylate Openeye Name: ethyl (4S)-2-amino-4-(4-chlorophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carboxylate CAS Name: (4S)-2-amino-4-(4-chlorophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-2-amino-4-(4-chlorophenyl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carboxylate Traditional Name: (4S)-2-amino-4-(4-chlorophenyl)-5-keto-7-methyl-4H-pyrano[3,2-c]pyran-3-carboxylic acid ethyl ester Formula: C18H16ClNO5 MolecularWeight: 361.77634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC=C(C=C3)Cl)C(=O)OC(=C2)C)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C([C@@H]1C3=CC=C(C=C3)Cl)C(=O)OC(=C2)C)N

InChI

InChI=1S/C18H16ClNO5/c1-3-23-17(21)15-13(10-4-6-11(19)7-5-10)14-12(25-16(15)20)8-9(2)24-18(14)22/h4-8,13H,3,20H2,1-2H3/t13-/m0/s1