3-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]propyl 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate

Systemtic Name: 3-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]propyl 3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate Openeye Name: 3-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]propyl 3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate CAS Name: 3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid 3-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]propyl ester IUPAC Name: 3-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]propyl 3-methyl-4-oxo-2-phenylchromene-8-carboxylate Traditional Name: 4-keto-3-methyl-2-phenyl-chromene-8-carboxylic acid 3-[[4-cyano-4-(3,4-dimethoxyphenyl)-5-methyl-hexyl]-methyl-amino]propyl ester Formula: C37H42N2O6 MolecularWeight: 610.73918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCCN(C)CCCC(C#N)(C3=CC(=C(C=C3)OC)OC)C(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)OCCCN(C)CCCC(C#N)(C3=CC(=C(C=C3)OC)OC)C(C)C)C4=CC=CC=C4

InChI

InChI=1S/C37H42N2O6/c1-25(2)37(24-38,28-17-18-31(42-5)32(23-28)43-6)19-11-20-39(4)21-12-22-44-36(41)30-16-10-15-29-33(40)26(3)34(45-35(29)30)27-13-8-7-9-14-27/h7-10,13-18,23,25H,11-12,19-22H2,1-6H3