4-(4-methoxyphenyl)-4-oxidanylidene-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]butanamide

Systemtic Name: 4-(4-methoxyphenyl)-4-oxidanylidene-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]butanamide Openeye Name: 4-(4-methoxyphenyl)-4-oxo-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]butanamide CAS Name: 4-(4-methoxyphenyl)-4-oxo-N-[(3S)-1-(3-phenylpropyl)-3-piperidin-1-iumyl]butanamide IUPAC Name: 4-(4-methoxyphenyl)-4-oxo-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]butanamide Traditional Name: 4-keto-4-(4-methoxyphenyl)-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]butyramide Formula: C25H33N2O3+ MolecularWeight: 409.54112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CCC(=O)NC2CCC[NH+](C2)CCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CCC(=O)N[C@H]2CCC[NH+](C2)CCCC3=CC=CC=C3

InChI

InChI=1S/C25H32N2O3/c1-30-23-13-11-21(12-14-23)24(28)15-16-25(29)26-22-10-6-18-27(19-22)17-5-9-20-7-3-2-4-8-20/h2-4,7-8,11-14,22H,5-6,9-10,15-19H2,1H3,(H,26,29)/p+1/t22-/m0/s1