6-chloranyl-N-[cyclopropyl-(4-methoxyphenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[cyclopropyl-(4-methoxyphenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[cyclopropyl-(4-methoxyphenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[cyclopropyl-(4-methoxyphenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[cyclopropyl-(4-methoxyphenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[cyclopropyl-(4-methoxyphenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C21H22ClNO4 MolecularWeight: 387.85668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2CC2)NC(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

Isomeric SMILES

COC1=CC=C(C=C1)C(C2CC2)NC(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C21H22ClNO4/c1-25-16-7-5-14(6-8-16)19(13-3-4-13)23-21(24)15-11-17(22)20-18(12-15)26-9-2-10-27-20/h5-8,11-13,19H,2-4,9-10H2,1H3,(H,23,24)