ethyl 2-azanyl-4-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carboxylate Openeye Name: ethyl 2-amino-4-(3-chloro-5-methoxy-4-prop-2-ynoxy-phenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate CAS Name: 2-amino-4-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carboxylate Traditional Name: 2-amino-4-(3-chloro-5-methoxy-4-propargyloxy-phenyl)-5-keto-4,6,7,8-tetrahydrochromene-3-carboxylic acid ethyl ester Formula: C22H22ClNO6 MolecularWeight: 431.86618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC(=C(C(=C3)Cl)OCC#C)OC)C(=O)CCC2)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C(C1C3=CC(=C(C(=C3)Cl)OCC#C)OC)C(=O)CCC2)N

InChI

InChI=1S/C22H22ClNO6/c1-4-9-29-20-13(23)10-12(11-16(20)27-3)17-18-14(25)7-6-8-15(18)30-21(24)19(17)22(26)28-5-2/h1,10-11,17H,5-9,24H2,2-3H3