N-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-benzamide

Systemtic Name: N-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-benzamide Openeye Name: N-[(1S)-2-amino-1-methyl-2-oxo-ethyl]-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-benzamide CAS Name: N-[(2S)-1-amino-1-oxopropan-2-yl]-2-[(1-cyclopentyl-4-piperidin-1-iumyl)oxy]-5-methoxybenzamide IUPAC Name: N-[(2S)-1-amino-1-oxopropan-2-yl]-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxybenzamide Traditional Name: N-[(1S)-2-amino-2-keto-1-methyl-ethyl]-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-5-methoxy-benzamide Formula: C21H32N3O4+ MolecularWeight: 390.49648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)NC(=O)C1=C(C=CC(=C1)OC)OC2CC[NH+](CC2)C3CCCC3

Isomeric SMILES

C[C@@H](C(=O)N)NC(=O)C1=C(C=CC(=C1)OC)OC2CC[NH+](CC2)C3CCCC3

InChI

InChI=1S/C21H31N3O4/c1-14(20(22)25)23-21(26)18-13-17(27-2)7-8-19(18)28-16-9-11-24(12-10-16)15-5-3-4-6-15/h7-8,13-16H,3-6,9-12H2,1-2H3,(H2,22,25)(H,23,26)/p+1/t14-/m0/s1