4-[[6-[(Z)-N-(furan-2-ylcarbonylamino)-C-methyl-carbonimidoyl]-1,3-benzodioxol-5-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[6-[(Z)-N-(furan-2-ylcarbonylamino)-C-methyl-carbonimidoyl]-1,3-benzodioxol-5-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[6-[(Z)-N-(furan-2-carbonylamino)-C-methyl-carbonimidoyl]-1,3-benzodioxol-5-yl]amino]-4-oxo-butanoate CAS Name: 4-[[6-[(1Z)-1-[[2-furanyl(oxo)methyl]hydrazinylidene]ethyl]-1,3-benzodioxol-5-yl]amino]-4-oxobutanoate IUPAC Name: 4-[[6-[(Z)-N-(furan-2-carbonylamino)-C-methylcarbonimidoyl]-1,3-benzodioxol-5-yl]amino]-4-oxobutanoate Traditional Name: 4-[[6-[(Z)-N-(2-furoylamino)-C-methyl-carbonimidoyl]-1,3-benzodioxol-5-yl]amino]-4-keto-butyrate Formula: C18H16N3O7- MolecularWeight: 386.33554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O7/c1-10(20-21-18(25)13-3-2-6-26-13)11-7-14-15(28-9-27-14)8-12(11)19-16(22)4-5-17(23)24/h2-3,6-8H,4-5,9H2,1H3,(H,19,22)(H,21,25)(H,23,24)/p-1/b20-10-