N-(1,3-benzodioxol-5-ylmethyl)-4,5-dimethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)aniline

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4,5-dimethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)aniline Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4,5-dimethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)aniline CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4,5-dimethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)aniline IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4,5-dimethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)aniline Traditional Name: [4,5-dimethoxy-2-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]-piperonyl-amine Formula: C17H16N5O4- MolecularWeight: 354.34004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2=NN=N[N-]2)NCC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2=NN=N[N-]2)NCC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C17H16N5O4/c1-23-14-6-11(17-19-21-22-20-17)12(7-15(14)24-2)18-8-10-3-4-13-16(5-10)26-9-25-13/h3-7,18H,8-9H2,1-2H3/q-1