ethyl 2-(4-methoxyphenyl)-2-(4-morpholin-4-ylphenyl)-5-oxidanyl-benzo[h]chromene-6-carboxylate

Systemtic Name: ethyl 2-(4-methoxyphenyl)-2-(4-morpholin-4-ylphenyl)-5-oxidanyl-benzo[h]chromene-6-carboxylate Openeye Name: ethyl 5-hydroxy-2-(4-methoxyphenyl)-2-(4-morpholinophenyl)benzo[h]chromene-6-carboxylate CAS Name: 5-hydroxy-2-(4-methoxyphenyl)-2-[4-(4-morpholinyl)phenyl]-6-benzo[h][1]benzopyrancarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-(4-methoxyphenyl)-2-(4-morpholin-4-ylphenyl)benzo[h]chromene-6-carboxylate Traditional Name: 5-hydroxy-2-(4-methoxyphenyl)-2-(4-morpholinophenyl)benzo[h]chromene-6-carboxylic acid ethyl ester Formula: C33H31NO6 MolecularWeight: 537.60234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C3=CC=CC=C31)OC(C=C2)(C4=CC=C(C=C4)N5CCOCC5)C6=CC=C(C=C6)OC)O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C3=CC=CC=C31)OC(C=C2)(C4=CC=C(C=C4)N5CCOCC5)C6=CC=C(C=C6)OC)O

InChI

InChI=1S/C33H31NO6/c1-3-39-32(36)29-26-6-4-5-7-27(26)31-28(30(29)35)16-17-33(40-31,23-10-14-25(37-2)15-11-23)22-8-12-24(13-9-22)34-18-20-38-21-19-34/h4-17,35H,3,18-21H2,1-2H3