N-(2-chloranyl-4,6-dimethyl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C18H18ClNO3 MolecularWeight: 331.79342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClNO3/c1-11-8-12(2)17(14(19)9-11)20-18(21)13-4-5-15-16(10-13)23-7-3-6-22-15/h4-5,8-10H,3,6-7H2,1-2H3,(H,20,21)