[4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 2,3-dimethoxybenzoate

Systemtic Name: [4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 2,3-dimethoxybenzoate Openeye Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl 2,3-dimethoxybenzoate CAS Name: 2,3-dimethoxybenzoic acid [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl 2,3-dimethoxybenzoate Traditional Name: 2,3-dimethoxybenzoic acid [4-amino-6-(o-toluidino)-s-triazin-2-yl]methyl ester Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)C3=C(C(=CC=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)C3=C(C(=CC=C3)OC)OC

InChI

InChI=1S/C20H21N5O4/c1-12-7-4-5-9-14(12)22-20-24-16(23-19(21)25-20)11-29-18(26)13-8-6-10-15(27-2)17(13)28-3/h4-10H,11H2,1-3H3,(H3,21,22,23,24,25)