(2S,4R)-4-(cyclooctylamino)-1-[(2,3-dimethoxyphenyl)methyl]-N-ethyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-4-(cyclooctylamino)-1-[(2,3-dimethoxyphenyl)methyl]-N-ethyl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-4-(cyclooctylamino)-1-[(2,3-dimethoxyphenyl)methyl]-N-ethyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-4-(cyclooctylamino)-1-[(2,3-dimethoxyphenyl)methyl]-N-ethyl-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-4-(cyclooctylamino)-1-[(2,3-dimethoxyphenyl)methyl]-N-ethylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-4-(cyclooctylamino)-N-ethyl-1-o-veratryl-pyrrolidine-2-carboxamide Formula: C24H39N3O3 MolecularWeight: 417.58476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1CC(CN1CC2=C(C(=CC=C2)OC)OC)NC3CCCCCCC3

Isomeric SMILES

CCNC(=O)[C@@H]1C[C@H](CN1CC2=C(C(=CC=C2)OC)OC)NC3CCCCCCC3

InChI

InChI=1S/C24H39N3O3/c1-4-25-24(28)21-15-20(26-19-12-8-6-5-7-9-13-19)17-27(21)16-18-11-10-14-22(29-2)23(18)30-3/h10-11,14,19-21,26H,4-9,12-13,15-17H2,1-3H3,(H,25,28)/t20-,21+/m1/s1