[3-[[6-[ethyl-(phenylmethyl)amino]pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[6-[ethyl-(phenylmethyl)amino]pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[[6-[benzyl(ethyl)amino]-3-pyridyl]amino]-3-oxo-propyl]ammonium CAS Name: [3-[[6-[ethyl-(phenylmethyl)amino]-3-pyridinyl]amino]-3-oxopropyl]ammonium IUPAC Name: [3-[[6-[benzyl(ethyl)amino]pyridin-3-yl]amino]-3-oxopropyl]azanium Traditional Name: [3-[[6-[benzyl(ethyl)amino]-3-pyridyl]amino]-3-keto-propyl]ammonium Formula: C17H23N4O+ MolecularWeight: 299.39072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O/c1-2-21(13-14-6-4-3-5-7-14)16-9-8-15(12-19-16)20-17(22)10-11-18/h3-9,12H,2,10-11,13,18H2,1H3,(H,20,22)/p+1