N-[1-[2-oxidanylidene-2-(pentan-3-ylamino)ethyl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: N-[1-[2-oxidanylidene-2-(pentan-3-ylamino)ethyl]piperidin-1-ium-4-yl]benzamide Openeye Name: N-[1-[2-(1-ethylpropylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]benzamide CAS Name: N-[1-[2-oxo-2-(pentan-3-ylamino)ethyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: N-[1-[2-oxo-2-(pentan-3-ylamino)ethyl]piperidin-1-ium-4-yl]benzamide Traditional Name: N-[1-[2-(1-ethylpropylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]benzamide Formula: C19H30N3O2+ MolecularWeight: 332.4604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C[NH+]1CCC(CC1)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(CC)NC(=O)C[NH+]1CCC(CC1)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H29N3O2/c1-3-16(4-2)20-18(23)14-22-12-10-17(11-13-22)21-19(24)15-8-6-5-7-9-15/h5-9,16-17H,3-4,10-14H2,1-2H3,(H,20,23)(H,21,24)/p+1