2-[N-(1,3-benzodioxol-5-ylmethyl)-C-methyl-carbonimidoyl]-3-oxidanylidene-inden-1-olate

Systemtic Name: 2-[N-(1,3-benzodioxol-5-ylmethyl)-C-methyl-carbonimidoyl]-3-oxidanylidene-inden-1-olate Openeye Name: 2-[N-(1,3-benzodioxol-5-ylmethyl)-C-methyl-carbonimidoyl]-3-oxo-inden-1-olate CAS Name: 2-[1-(1,3-benzodioxol-5-ylmethylimino)ethyl]-3-oxo-1-indenolate IUPAC Name: 2-[N-(1,3-benzodioxol-5-ylmethyl)-C-methylcarbonimidoyl]-3-oxoinden-1-olate Traditional Name: 3-keto-2-(C-methyl-N-piperonyl-carbonimidoyl)inden-1-olate Formula: C19H14NO4- MolecularWeight: 320.31876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC1=CC2=C(C=C1)OCO2)C3=C(C4=CC=CC=C4C3=O)[O-]

Isomeric SMILES

CC(=NCC1=CC2=C(C=C1)OCO2)C3=C(C4=CC=CC=C4C3=O)[O-]

InChI

InChI=1S/C19H15NO4/c1-11(17-18(21)13-4-2-3-5-14(13)19(17)22)20-9-12-6-7-15-16(8-12)24-10-23-15/h2-8,21H,9-10H2,1H3/p-1