hexyl 6,6-bis[[4-(diethylamino)-2-oxidanyl-phenyl]carbonyl]cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: hexyl 6,6-bis[[4-(diethylamino)-2-oxidanyl-phenyl]carbonyl]cyclohexa-2,4-diene-1-carboxylate Openeye Name: hexyl 6,6-bis[4-(diethylamino)-2-hydroxy-benzoyl]cyclohexa-2,4-diene-1-carboxylate CAS Name: 6,6-bis[[4-(diethylamino)-2-hydroxyphenyl]-oxomethyl]-1-cyclohexa-2,4-dienecarboxylic acid hexyl ester IUPAC Name: hexyl 6,6-bis[4-(diethylamino)-2-hydroxybenzoyl]cyclohexa-2,4-diene-1-carboxylate Traditional Name: 6,6-bis[4-(diethylamino)-2-hydroxy-benzoyl]cyclohexa-2,4-diene-1-carboxylic acid hexyl ester Formula: C35H46N2O6 MolecularWeight: 590.74954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1C=CC=CC1(C(=O)C2=C(C=C(C=C2)N(CC)CC)O)C(=O)C3=C(C=C(C=C3)N(CC)CC)O

Isomeric SMILES

CCCCCCOC(=O)C1C=CC=CC1(C(=O)C2=C(C=C(C=C2)N(CC)CC)O)C(=O)C3=C(C=C(C=C3)N(CC)CC)O

InChI

InChI=1S/C35H46N2O6/c1-6-11-12-15-22-43-34(42)29-16-13-14-21-35(29,32(40)27-19-17-25(23-30(27)38)36(7-2)8-3)33(41)28-20-18-26(24-31(28)39)37(9-4)10-5/h13-14,16-21,23-24,29,38-39H,6-12,15,22H2,1-5H3