1-[(1S)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1S)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1S)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1S)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-1-(4-amino-6-anilino-s-triazin-2-yl)ethyl]piperidin-1-ium-4-carboxamide Formula: C17H24N7O+ MolecularWeight: 342.41876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

C[C@@H](C1=NC(=NC(=N1)NC2=CC=CC=C2)N)[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C17H23N7O/c1-11(24-9-7-12(8-10-24)14(18)25)15-21-16(19)23-17(22-15)20-13-5-3-2-4-6-13/h2-6,11-12H,7-10H2,1H3,(H2,18,25)(H3,19,20,21,22,23)/p+1/t11-/m0/s1