4-(1,3-benzodioxol-5-ylcarbonyl)-N-(cyclopropylmethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-ylcarbonyl)-N-(cyclopropylmethyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-(1,3-benzodioxole-5-carbonyl)-N-(cyclopropylmethyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[1,3-benzodioxol-5-yl(oxo)methyl]-N-(cyclopropylmethyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-(1,3-benzodioxole-5-carbonyl)-N-(cyclopropylmethyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(cyclopropylmethyl)-4-piperonyloyl-1,4-diazepane-1-carboxamide Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NCC2CC2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN(C1)C(=O)NCC2CC2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H23N3O4/c22-17(14-4-5-15-16(10-14)25-12-24-15)20-6-1-7-21(9-8-20)18(23)19-11-13-2-3-13/h4-5,10,13H,1-3,6-9,11-12H2,(H,19,23)