N-[1-[(2S)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: N-[1-[(2S)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-yl]benzamide Openeye Name: N-[1-[(1S)-2-(cyclopentylamino)-1-methyl-2-oxo-ethyl]piperidin-1-ium-4-yl]benzamide CAS Name: N-[1-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]-4-piperidin-1-iumyl]benzamide IUPAC Name: N-[1-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]piperidin-1-ium-4-yl]benzamide Traditional Name: N-[1-[(1S)-2-(cyclopentylamino)-2-keto-1-methyl-ethyl]piperidin-1-ium-4-yl]benzamide Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1CCCC1)[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H29N3O2/c1-15(19(24)21-17-9-5-6-10-17)23-13-11-18(12-14-23)22-20(25)16-7-3-2-4-8-16/h2-4,7-8,15,17-18H,5-6,9-14H2,1H3,(H,21,24)(H,22,25)/p+1/t15-/m0/s1