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

Systemtic Name: 6-azanyl-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)heptan-3-one Openeye Name: 6-amino-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)heptan-3-one CAS Name: 6-amino-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)-3-heptanone IUPAC Name: 6-amino-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)heptan-3-one Traditional Name: 6-amino-1-(4-chlorophenyl)-7-(3,4-dimethoxyphenyl)heptan-3-one Formula: C21H26ClNO3 MolecularWeight: 375.88904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClNO3/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/h3-4,6-8,12,14,18H,5,9-11,13,23H2,1-2H3