[3-[(2-methoxy-5-methyl-phenyl)-(pyridin-3-ylmethyl)amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[(2-methoxy-5-methyl-phenyl)-(pyridin-3-ylmethyl)amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[2-methoxy-5-methyl-N-(3-pyridylmethyl)anilino]-3-oxo-propyl]ammonium CAS Name: [3-[2-methoxy-5-methyl-N-(3-pyridinylmethyl)anilino]-3-oxopropyl]ammonium IUPAC Name: [3-[2-methoxy-5-methyl-N-(pyridin-3-ylmethyl)anilino]-3-oxopropyl]azanium Traditional Name: [3-keto-3-[2-methoxy-5-methyl-N-(3-pyridylmethyl)anilino]propyl]ammonium Formula: C17H22N3O2+ MolecularWeight: 300.37548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O2/c1-13-5-6-16(22-2)15(10-13)20(17(21)7-8-18)12-14-4-3-9-19-11-14/h3-6,9-11H,7-8,12,18H2,1-2H3/p+1