[3-[[6-[(4-methylphenyl)methylamino]pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[6-[(4-methylphenyl)methylamino]pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-oxo-3-[[6-(p-tolylmethylamino)-3-pyridyl]amino]propyl]ammonium CAS Name: [3-[[6-[(4-methylphenyl)methylamino]-3-pyridinyl]amino]-3-oxopropyl]ammonium IUPAC Name: [3-[[6-[(4-methylphenyl)methylamino]pyridin-3-yl]amino]-3-oxopropyl]azanium Traditional Name: [3-keto-3-[[6-[(4-methylbenzyl)amino]-3-pyridyl]amino]propyl]ammonium Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC=C(C=C2)NC(=O)CC[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC=C(C=C2)NC(=O)CC[NH3+]

InChI

InChI=1S/C16H20N4O/c1-12-2-4-13(5-3-12)10-18-15-7-6-14(11-19-15)20-16(21)8-9-17/h2-7,11H,8-10,17H2,1H3,(H,18,19)(H,20,21)/p+1