[3-[[6-[2-(4-methoxyphenyl)ethylamino]pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[6-[2-(4-methoxyphenyl)ethylamino]pyridin-3-yl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridyl]amino]-3-oxo-propyl]ammonium CAS Name: [3-[[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]amino]-3-oxopropyl]ammonium IUPAC Name: [3-[[6-[2-(4-methoxyphenyl)ethylamino]pyridin-3-yl]amino]-3-oxopropyl]azanium Traditional Name: [3-keto-3-[[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridyl]amino]propyl]ammonium Formula: C17H23N4O2+ MolecularWeight: 315.39012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC2=NC=C(C=C2)NC(=O)CC[NH3+]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC2=NC=C(C=C2)NC(=O)CC[NH3+]

InChI

InChI=1S/C17H22N4O2/c1-23-15-5-2-13(3-6-15)9-11-19-16-7-4-14(12-20-16)21-17(22)8-10-18/h2-7,12H,8-11,18H2,1H3,(H,19,20)(H,21,22)/p+1