[3-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]amino]-3-oxo-propyl]ammonium CAS Name: [3-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridinyl]amino]-3-oxopropyl]ammonium IUPAC Name: [3-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridin-3-yl]amino]-3-oxopropyl]azanium Traditional Name: [3-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyridyl]amino]-3-keto-propyl]ammonium Formula: C17H21N4O+ MolecularWeight: 297.37484

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC=C(C=C3)NC(=O)CC[NH3+]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC=C(C=C3)NC(=O)CC[NH3+]

InChI

InChI=1S/C17H20N4O/c18-9-7-17(22)20-15-5-6-16(19-11-15)21-10-8-13-3-1-2-4-14(13)12-21/h1-6,11H,7-10,12,18H2,(H,20,22)/p+1