N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-N-(pyridin-3-ylmethyl)propan-2-amine

Systemtic Name: N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-N-(pyridin-3-ylmethyl)propan-2-amine Openeye Name: N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-N-(3-pyridylmethyl)propan-2-amine CAS Name: N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-N-(3-pyridinylmethyl)-2-propanamine IUPAC Name: N-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-N-(pyridin-3-ylmethyl)propan-2-amine Traditional Name: isopropyl-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-(3-pyridylmethyl)amine Formula: C18H20N6O2 MolecularWeight: 352.3904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CN=CC=C1)CN2C=NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N(CC1=CN=CC=C1)CN2C=NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N6O2/c1-14(2)22(11-15-4-3-9-19-10-15)13-23-12-20-18(21-23)16-5-7-17(8-6-16)24(25)26/h3-10,12,14H,11,13H2,1-2H3