[3-[(2,3-dimethylphenyl)-(pyridin-4-ylmethyl)amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[(2,3-dimethylphenyl)-(pyridin-4-ylmethyl)amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[2,3-dimethyl-N-(4-pyridylmethyl)anilino]-3-oxo-propyl]ammonium CAS Name: [3-[2,3-dimethyl-N-(pyridin-4-ylmethyl)anilino]-3-oxopropyl]ammonium IUPAC Name: [3-[2,3-dimethyl-N-(pyridin-4-ylmethyl)anilino]-3-oxopropyl]azanium Traditional Name: [3-[2,3-dimethyl-N-(4-pyridylmethyl)anilino]-3-keto-propyl]ammonium Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(CC2=CC=NC=C2)C(=O)CC[NH3+])C

Isomeric SMILES

CC1=C(C(=CC=C1)N(CC2=CC=NC=C2)C(=O)CC[NH3+])C

InChI

InChI=1S/C17H21N3O/c1-13-4-3-5-16(14(13)2)20(17(21)6-9-18)12-15-7-10-19-11-8-15/h3-5,7-8,10-11H,6,9,12,18H2,1-2H3/p+1