(2S)-N-(3-chlorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carboxamide

Systemtic Name: (2S)-N-(3-chlorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carboxamide Openeye Name: (2S)-N-(3-chlorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carboxamide CAS Name: (2S)-N-(3-chlorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(3-chlorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carboxamide Traditional Name: (2S)-N-(3-chlorophenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carboxamide Formula: C20H21ClN2O3 MolecularWeight: 372.84534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)NC2=CC(=CC=C2)Cl)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)NC2=CC(=CC=C2)Cl)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H21ClN2O3/c21-15-4-1-5-16(13-15)22-20(24)23-9-2-6-17(23)14-7-8-18-19(12-14)26-11-3-10-25-18/h1,4-5,7-8,12-13,17H,2-3,6,9-11H2,(H,22,24)/t17-/m0/s1