N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-N-cyclopropyl-5-(2,5-dimethoxyphenyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-N-cyclopropyl-5-(2,5-dimethoxyphenyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-propyl]-N-cyclopropyl-5-(2,5-dimethoxyphenyl)isoxazole-3-carboxamide CAS Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-cyclopropyl-5-(2,5-dimethoxyphenyl)-3-isoxazolecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-cyclopropyl-5-(2,5-dimethoxyphenyl)-1,2-oxazole-3-carboxamide Traditional Name: N-cyclopropyl-5-(2,5-dimethoxyphenyl)-N-[3-keto-3-(piperonylamino)propyl]isoxazole-3-carboxamide Formula: C26H27N3O7 MolecularWeight: 493.50848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CC(=NO2)C(=O)N(CCC(=O)NCC3=CC4=C(C=C3)OCO4)C5CC5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CC(=NO2)C(=O)N(CCC(=O)NCC3=CC4=C(C=C3)OCO4)C5CC5

InChI

InChI=1S/C26H27N3O7/c1-32-18-6-8-21(33-2)19(12-18)23-13-20(28-36-23)26(31)29(17-4-5-17)10-9-25(30)27-14-16-3-7-22-24(11-16)35-15-34-22/h3,6-8,11-13,17H,4-5,9-10,14-15H2,1-2H3,(H,27,30)