[(3S)-1-(5-methoxy-5-oxidanylidene-pentanoyl)piperidin-3-yl]-methyl-(phenylmethyl)azanium

Systemtic Name: [(3S)-1-(5-methoxy-5-oxidanylidene-pentanoyl)piperidin-3-yl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(3S)-1-(5-methoxy-5-oxo-pentanoyl)-3-piperidyl]-methyl-ammonium CAS Name: [(3S)-1-(5-methoxy-1,5-dioxopentyl)-3-piperidinyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(3S)-1-(5-methoxy-5-oxopentanoyl)piperidin-3-yl]-methylazanium Traditional Name: benzyl-[(3S)-1-(5-keto-5-methoxy-pentanoyl)-3-piperidyl]-methyl-ammonium Formula: C19H29N2O3+ MolecularWeight: 333.44516

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2CCCN(C2)C(=O)CCCC(=O)OC

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)[C@H]2CCCN(C2)C(=O)CCCC(=O)OC

InChI

InChI=1S/C19H28N2O3/c1-20(14-16-8-4-3-5-9-16)17-10-7-13-21(15-17)18(22)11-6-12-19(23)24-2/h3-5,8-9,17H,6-7,10-15H2,1-2H3/p+1/t17-/m0/s1