N-cyclopropyl-4-methoxy-3-[1-[(3S)-3-phenylbutyl]piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-cyclopropyl-4-methoxy-3-[1-[(3S)-3-phenylbutyl]piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-cyclopropyl-4-methoxy-3-[1-[(3S)-3-phenylbutyl]piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-cyclopropyl-4-methoxy-3-[[1-[(3S)-3-phenylbutyl]-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-cyclopropyl-4-methoxy-3-[1-[(3S)-3-phenylbutyl]piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-cyclopropyl-4-methoxy-3-[1-[(3S)-3-phenylbutyl]piperidin-1-ium-4-yl]oxy-benzamide Formula: C26H35N2O3+ MolecularWeight: 423.5677

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC[NH+]1CCC(CC1)OC2=C(C=CC(=C2)C(=O)NC3CC3)OC)C4=CC=CC=C4

Isomeric SMILES

C[C@@H](CC[NH+]1CCC(CC1)OC2=C(C=CC(=C2)C(=O)NC3CC3)OC)C4=CC=CC=C4

InChI

InChI=1S/C26H34N2O3/c1-19(20-6-4-3-5-7-20)12-15-28-16-13-23(14-17-28)31-25-18-21(8-11-24(25)30-2)26(29)27-22-9-10-22/h3-8,11,18-19,22-23H,9-10,12-17H2,1-2H3,(H,27,29)/p+1/t19-/m0/s1