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

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-N-cyclopropyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-N-cyclopropyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-N-cyclopropyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-N-cyclopropyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(1,3-benzodioxol-4-ylmethyl)-N-cyclopropyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)N(CC3=C4C(=CC=C3)OCO4)C5CC5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)N(CC3=C4C(=CC=C3)OCO4)C5CC5)OC1

InChI

InChI=1S/C21H21NO5/c23-21(14-5-8-17-19(11-14)25-10-2-9-24-17)22(16-6-7-16)12-15-3-1-4-18-20(15)27-13-26-18/h1,3-5,8,11,16H,2,6-7,9-10,12-13H2