6-chloranyl-N-(2,3-dimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-(2,3-dimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-(2,3-dimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-(2,3-dimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-(2,3-dimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-(2,3-dimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C18H18ClNO3 MolecularWeight: 331.79342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3)C

InChI

InChI=1S/C18H18ClNO3/c1-11-5-3-6-15(12(11)2)20-18(21)13-9-14(19)17-16(10-13)22-7-4-8-23-17/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,20,21)