N-(1,3-benzodioxol-4-ylmethyl)-N-(phenylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(phenylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-N-benzyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(phenylmethyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-N-benzyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(1,3-benzodioxol-4-ylmethyl)-N-benzyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C25H23NO5 MolecularWeight: 417.45382

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)N(CC3=CC=CC=C3)CC4=C5C(=CC=C4)OCO5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)N(CC3=CC=CC=C3)CC4=C5C(=CC=C4)OCO5)OC1

InChI

InChI=1S/C25H23NO5/c27-25(19-10-11-21-23(14-19)29-13-5-12-28-21)26(15-18-6-2-1-3-7-18)16-20-8-4-9-22-24(20)31-17-30-22/h1-4,6-11,14H,5,12-13,15-17H2