[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 4-(1H-indol-3-yl)butanoate

Systemtic Name: [4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 4-(1H-indol-3-yl)butanoate Openeye Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid [4-amino-6-(dimethylamino)-s-triazin-2-yl]methyl ester Formula: C18H22N6O2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=N1)N)COC(=O)CCCC2=CNC3=CC=CC=C32

Isomeric SMILES

CN(C)C1=NC(=NC(=N1)N)COC(=O)CCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C18H22N6O2/c1-24(2)18-22-15(21-17(19)23-18)11-26-16(25)9-5-6-12-10-20-14-8-4-3-7-13(12)14/h3-4,7-8,10,20H,5-6,9,11H2,1-2H3,(H2,19,21,22,23)