N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-[2-(2,3-dimethylanilino)-2-oxo-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-[2-(2,3-dimethylanilino)-2-keto-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C21H24N2O4 MolecularWeight: 368.42626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O4/c1-14-6-4-7-17(15(14)2)22-20(24)13-23(3)21(25)16-8-9-18-19(12-16)27-11-5-10-26-18/h4,6-9,12H,5,10-11,13H2,1-3H3,(H,22,24)