3-[(4-methoxyphenyl)-(2-piperidin-1-ium-1-ylethanoyl)amino]propanamide

Systemtic Name: 3-[(4-methoxyphenyl)-(2-piperidin-1-ium-1-ylethanoyl)amino]propanamide Openeye Name: 3-(4-methoxy-N-(2-piperidin-1-ium-1-ylacetyl)anilino)propanamide CAS Name: 3-(4-methoxy-N-[1-oxo-2-(1-piperidin-1-iumyl)ethyl]anilino)propanamide IUPAC Name: 3-(4-methoxy-N-(2-piperidin-1-ium-1-ylacetyl)anilino)propanamide Traditional Name: 3-(4-methoxy-N-(2-piperidin-1-ium-1-ylacetyl)anilino)propionamide Formula: C17H26N3O3+ MolecularWeight: 320.40664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CCC(=O)N)C(=O)C[NH+]2CCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)N(CCC(=O)N)C(=O)C[NH+]2CCCCC2

InChI

InChI=1S/C17H25N3O3/c1-23-15-7-5-14(6-8-15)20(12-9-16(18)21)17(22)13-19-10-3-2-4-11-19/h5-8H,2-4,9-13H2,1H3,(H2,18,21)/p+1