3-chloranyl-5-methoxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-propoxy-benzamide

Systemtic Name: 3-chloranyl-5-methoxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-propoxy-benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-chloro-5-methoxy-4-propoxy-benzamide CAS Name: 3-chloro-5-methoxy-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-propoxybenzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-chloro-5-methoxy-4-propoxybenzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-chloro-5-methoxy-4-propoxy-benzamide Formula: C23H30ClN2O3+ MolecularWeight: 417.9489

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C23H29ClN2O3/c1-3-13-29-22-20(24)14-18(15-21(22)28-2)23(27)25-19-9-11-26(12-10-19)16-17-7-5-4-6-8-17/h4-8,14-15,19H,3,9-13,16H2,1-2H3,(H,25,27)/p+1