[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]-(1,3-benzodioxol-5-ylmethyl)-cyclopentyl-azanium

Systemtic Name: [2-(aminocarbonylamino)-2-oxidanylidene-ethyl]-(1,3-benzodioxol-5-ylmethyl)-cyclopentyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-cyclopentyl-(2-oxo-2-ureido-ethyl)ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-(carbamoylamino)-2-oxoethyl]-cyclopentylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-(carbamoylamino)-2-oxoethyl]-cyclopentylazanium Traditional Name: cyclopentyl-(2-keto-2-ureido-ethyl)-piperonyl-ammonium Formula: C16H22N3O4+ MolecularWeight: 320.36358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+](CC2=CC3=C(C=C2)OCO3)CC(=O)NC(=O)N

Isomeric SMILES

C1CCC(C1)[NH+](CC2=CC3=C(C=C2)OCO3)CC(=O)NC(=O)N

InChI

InChI=1S/C16H21N3O4/c17-16(21)18-15(20)9-19(12-3-1-2-4-12)8-11-5-6-13-14(7-11)23-10-22-13/h5-7,12H,1-4,8-10H2,(H3,17,18,20,21)/p+1