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

Systemtic Name: 6-chloranyl-N-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[2-(4-methoxyanilino)-2-oxo-ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[2-(4-methoxyanilino)-2-oxoethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[2-keto-2-(p-anisidino)ethyl]-N-methyl-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C20H21ClN2O5 MolecularWeight: 404.84414

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)OC)C(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)OC)C(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C20H21ClN2O5/c1-23(12-18(24)22-14-4-6-15(26-2)7-5-14)20(25)13-10-16(21)19-17(11-13)27-8-3-9-28-19/h4-7,10-11H,3,8-9,12H2,1-2H3,(H,22,24)