N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine

Systemtic Name: N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine CAS Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine IUPAC Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-amine Traditional Name: (4-benzoxy-3-methoxy-benzyl)-(1,2,3-triaza-4-azanidacyclopenta-2,5-dien-5-yl)amine Formula: C16H16N5O2- MolecularWeight: 310.33054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=NN=N[N-]2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=NN=N[N-]2)OCC3=CC=CC=C3

InChI

InChI=1S/C16H16N5O2/c1-22-15-9-13(10-17-16-18-20-21-19-16)7-8-14(15)23-11-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H-,17,18,19,20,21)/q-1