2-(3,5-dimethylphenoxy)-N-[(1-propan-2-ylpiperidin-1-ium-4-ylidene)amino]ethanamide

Systemtic Name: 2-(3,5-dimethylphenoxy)-N-[(1-propan-2-ylpiperidin-1-ium-4-ylidene)amino]ethanamide Openeye Name: 2-(3,5-dimethylphenoxy)-N-[(1-isopropylpiperidin-1-ium-4-ylidene)amino]acetamide CAS Name: 2-(3,5-dimethylphenoxy)-N-[(1-propan-2-yl-4-piperidin-1-iumylidene)amino]acetamide IUPAC Name: 2-(3,5-dimethylphenoxy)-N-[(1-propan-2-ylpiperidin-1-ium-4-ylidene)amino]acetamide Traditional Name: 2-(3,5-dimethylphenoxy)-N-[(1-isopropylpiperidin-1-ium-4-ylidene)amino]acetamide Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NN=C2CC[NH+](CC2)C(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NN=C2CC[NH+](CC2)C(C)C)C

InChI

InChI=1S/C18H27N3O2/c1-13(2)21-7-5-16(6-8-21)19-20-18(22)12-23-17-10-14(3)9-15(4)11-17/h9-11,13H,5-8,12H2,1-4H3,(H,20,22)/p+1