[3-[(3,5-dimethylphenyl)-(pyridin-3-ylmethyl)amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[(3,5-dimethylphenyl)-(pyridin-3-ylmethyl)amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[3,5-dimethyl-N-(3-pyridylmethyl)anilino]-3-oxo-propyl]ammonium CAS Name: [3-[3,5-dimethyl-N-(3-pyridinylmethyl)anilino]-3-oxopropyl]ammonium IUPAC Name: [3-[3,5-dimethyl-N-(pyridin-3-ylmethyl)anilino]-3-oxopropyl]azanium Traditional Name: [3-[3,5-dimethyl-N-(3-pyridylmethyl)anilino]-3-keto-propyl]ammonium Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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