[4-[2-(3,4-dichlorophenyl)ethanoyl-methyl-amino]-5-pyrrolidin-1-yl-cycloheptyl] ethanoate

Systemtic Name: [4-[2-(3,4-dichlorophenyl)ethanoyl-methyl-amino]-5-pyrrolidin-1-yl-cycloheptyl] ethanoate Openeye Name: [4-[[2-(3,4-dichlorophenyl)acetyl]-methyl-amino]-5-pyrrolidin-1-yl-cycloheptyl] acetate CAS Name: acetic acid [4-[[2-(3,4-dichlorophenyl)-1-oxoethyl]-methylamino]-5-(1-pyrrolidinyl)cycloheptyl] ester IUPAC Name: [4-[[2-(3,4-dichlorophenyl)acetyl]-methylamino]-5-pyrrolidin-1-ylcycloheptyl] acetate Traditional Name: acetic acid [4-[[2-(3,4-dichlorophenyl)acetyl]-methyl-amino]-5-pyrrolidino-cycloheptyl] ester Formula: C22H30Cl2N2O3 MolecularWeight: 441.3912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC(C(CC1)N(C)C(=O)CC2=CC(=C(C=C2)Cl)Cl)N3CCCC3

Isomeric SMILES

CC(=O)OC1CCC(C(CC1)N(C)C(=O)CC2=CC(=C(C=C2)Cl)Cl)N3CCCC3

InChI

InChI=1S/C22H30Cl2N2O3/c1-15(27)29-17-6-9-20(21(10-7-17)26-11-3-4-12-26)25(2)22(28)14-16-5-8-18(23)19(24)13-16/h5,8,13,17,20-21H,3-4,6-7,9-12,14H2,1-2H3