5-chloranyl-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-N-prop-2-enyl-N-prop-2-ynyl-benzamide

Systemtic Name: 5-chloranyl-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-N-prop-2-enyl-N-prop-2-ynyl-benzamide Openeye Name: N-allyl-5-chloro-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-N-prop-2-ynyl-benzamide CAS Name: 5-chloro-2-[(1-cyclopentyl-4-piperidin-1-iumyl)oxy]-N-prop-2-enyl-N-prop-2-ynylbenzamide IUPAC Name: 5-chloro-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-N-prop-2-enyl-N-prop-2-ynylbenzamide Traditional Name: N-allyl-5-chloro-2-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-N-propargyl-benzamide Formula: C23H30ClN2O2+ MolecularWeight: 401.9495

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC#C)C(=O)C1=C(C=CC(=C1)Cl)OC2CC[NH+](CC2)C3CCCC3

Isomeric SMILES

C=CCN(CC#C)C(=O)C1=C(C=CC(=C1)Cl)OC2CC[NH+](CC2)C3CCCC3

InChI

InChI=1S/C23H29ClN2O2/c1-3-13-26(14-4-2)23(27)21-17-18(24)9-10-22(21)28-20-11-15-25(16-12-20)19-7-5-6-8-19/h1,4,9-10,17,19-20H,2,5-8,11-16H2/p+1