N-[4-methyl-6-[1-[(3-nitrophenyl)methoxy]butan-2-ylamino]-1,3,5-triazin-2-yl]ethanamide

Systemtic Name: N-[4-methyl-6-[1-[(3-nitrophenyl)methoxy]butan-2-ylamino]-1,3,5-triazin-2-yl]ethanamide Openeye Name: N-[4-methyl-6-[1-[(3-nitrophenyl)methoxymethyl]propylamino]-1,3,5-triazin-2-yl]acetamide CAS Name: N-[4-methyl-6-[1-[(3-nitrophenyl)methoxy]butan-2-ylamino]-1,3,5-triazin-2-yl]acetamide IUPAC Name: N-[4-methyl-6-[1-[(3-nitrophenyl)methoxy]butan-2-ylamino]-1,3,5-triazin-2-yl]acetamide Traditional Name: N-[4-methyl-6-[1-[(3-nitrobenzyl)oxymethyl]propylamino]-s-triazin-2-yl]acetamide Formula: C17H22N6O4 MolecularWeight: 374.39438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COCC1=CC(=CC=C1)[N+](=O)[O-])NC2=NC(=NC(=N2)NC(=O)C)C

Isomeric SMILES

CCC(COCC1=CC(=CC=C1)[N+](=O)[O-])NC2=NC(=NC(=N2)NC(=O)C)C

InChI

InChI=1S/C17H22N6O4/c1-4-14(10-27-9-13-6-5-7-15(8-13)23(25)26)21-17-19-11(2)18-16(22-17)20-12(3)24/h5-8,14H,4,9-10H2,1-3H3,(H2,18,19,20,21,22,24)