6-[(4-methoxyphenyl)methyl]-3-[(2-methyl-4-nitro-phenyl)amino]-2H-1,2,4-triazin-5-one

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-3-[(2-methyl-4-nitro-phenyl)amino]-2H-1,2,4-triazin-5-one Openeye Name: 6-[(4-methoxyphenyl)methyl]-3-(2-methyl-4-nitro-anilino)-2H-1,2,4-triazin-5-one CAS Name: 6-[(4-methoxyphenyl)methyl]-3-(2-methyl-4-nitroanilino)-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(4-methoxyphenyl)methyl]-3-(2-methyl-4-nitroanilino)-2H-1,2,4-triazin-5-one Traditional Name: 3-(2-methyl-4-nitro-anilino)-6-p-anisyl-2H-1,2,4-triazin-5-one Formula: C18H17N5O4 MolecularWeight: 367.35868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2=NC(=O)C(=NN2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2=NC(=O)C(=NN2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C18H17N5O4/c1-11-9-13(23(25)26)5-8-15(11)19-18-20-17(24)16(21-22-18)10-12-3-6-14(27-2)7-4-12/h3-9H,10H2,1-2H3,(H2,19,20,22,24)