N-[(2-methylphenyl)methyl]-N-(2-methylpropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[(2-methylphenyl)methyl]-N-(2-methylpropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-isobutyl-N-(o-tolylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[(2-methylphenyl)methyl]-N-(2-methylpropyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[(2-methylphenyl)methyl]-N-(2-methylpropyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-isobutyl-N-(2-methylbenzyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC(C)C)C(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC=CC=C1CN(CC(C)C)C(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C22H27NO3/c1-16(2)14-23(15-19-8-5-4-7-17(19)3)22(24)18-9-10-20-21(13-18)26-12-6-11-25-20/h4-5,7-10,13,16H,6,11-12,14-15H2,1-3H3