6-azanyl-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)heptan-3-one; ethene

Systemtic Name: 6-azanyl-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)heptan-3-one; ethene Openeye Name: 6-amino-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)heptan-3-one; ethylene CAS Name: 6-amino-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)-3-heptanone; ethene IUPAC Name: 6-amino-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)heptan-3-one; ethene Traditional Name: 6-amino-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)heptan-3-one; ethylene Formula: C23H30ClNO3 MolecularWeight: 403.9422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(CCC(=O)CCC2=CC=C(C=C2)Cl)N)OC.C=C

Isomeric SMILES

COC1=C(C=C(C=C1)CC(CCC(=O)CCC2=CC=C(C=C2)Cl)N)OC.C=C

InChI

InChI=1S/C21H26ClNO3.C2H4/c1-25-20-12-6-16(14-21(20)26-2)13-18(23)9-11-19(24)10-5-15-3-7-17(22)8-4-15;1-2/h3-4,6-8,12,14,18H,5,9-11,13,23H2,1-2H3;1-2H2