5-[[6-[(E)-N-(furan-2-ylcarbonylamino)-C-methyl-carbonimidoyl]-1,3-benzodioxol-5-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[[6-[(E)-N-(furan-2-ylcarbonylamino)-C-methyl-carbonimidoyl]-1,3-benzodioxol-5-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: 5-[[6-[(E)-N-(furan-2-carbonylamino)-C-methyl-carbonimidoyl]-1,3-benzodioxol-5-yl]amino]-5-oxo-pentanoate CAS Name: 5-[[6-[(1E)-1-[[2-furanyl(oxo)methyl]hydrazinylidene]ethyl]-1,3-benzodioxol-5-yl]amino]-5-oxopentanoate IUPAC Name: 5-[[6-[(E)-N-(furan-2-carbonylamino)-C-methylcarbonimidoyl]-1,3-benzodioxol-5-yl]amino]-5-oxopentanoate Traditional Name: 5-[[6-[(E)-N-(2-furoylamino)-C-methyl-carbonimidoyl]-1,3-benzodioxol-5-yl]amino]-5-keto-valerate Formula: C19H18N3O7- MolecularWeight: 400.36212

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CO1)C2=CC3=C(C=C2NC(=O)CCCC(=O)[O-])OCO3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=CO1)/C2=CC3=C(C=C2NC(=O)CCCC(=O)[O-])OCO3

InChI

InChI=1S/C19H19N3O7/c1-11(21-22-19(26)14-4-3-7-27-14)12-8-15-16(29-10-28-15)9-13(12)20-17(23)5-2-6-18(24)25/h3-4,7-9H,2,5-6,10H2,1H3,(H,20,23)(H,22,26)(H,24,25)/p-1/b21-11+