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

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(1-phenylethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(1-phenylethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(1-phenylethyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(1-phenylethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(1,3-benzodioxol-4-ylmethyl)-N-(1-phenylethyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C26H25NO5 MolecularWeight: 431.4804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=C3C(=CC=C2)OCO3)C(=O)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

CC(C1=CC=CC=C1)N(CC2=C3C(=CC=C2)OCO3)C(=O)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C26H25NO5/c1-18(19-7-3-2-4-8-19)27(16-21-9-5-10-23-25(21)32-17-31-23)26(28)20-11-12-22-24(15-20)30-14-6-13-29-22/h2-5,7-12,15,18H,6,13-14,16-17H2,1H3