4-azanyl-N5-(1,3-benzodioxol-5-ylmethyl)-N5-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-1,2-oxazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(1,3-benzodioxol-5-ylmethyl)-N5-[2-(cyclopentylamino)-2-oxidanylidene-ethyl]-1,2-oxazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(1,3-benzodioxol-5-ylmethyl)-N5-[2-(cyclopentylamino)-2-oxo-ethyl]isoxazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(1,3-benzodioxol-5-ylmethyl)-N5-[2-(cyclopentylamino)-2-oxoethyl]isoxazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(1,3-benzodioxol-5-ylmethyl)-5-N-[2-(cyclopentylamino)-2-oxoethyl]-1,2-oxazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(cyclopentylamino)-2-keto-ethyl]-N'-piperonyl-isoxazole-3,5-dicarboxamide Formula: C20H23N5O6 MolecularWeight: 429.42652

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=C(C(=NO4)C(=O)N)N

Isomeric SMILES

C1CCC(C1)NC(=O)CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4=C(C(=NO4)C(=O)N)N

InChI

InChI=1S/C20H23N5O6/c21-16-17(19(22)27)24-31-18(16)20(28)25(9-15(26)23-12-3-1-2-4-12)8-11-5-6-13-14(7-11)30-10-29-13/h5-7,12H,1-4,8-10,21H2,(H2,22,27)(H,23,26)