3-chloranyl-4-ethoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide

Systemtic Name: 3-chloranyl-4-ethoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide Openeye Name: 3-chloro-4-ethoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide CAS Name: 3-chloro-4-ethoxy-N-[4-(1-piperidin-1-iumylmethyl)phenyl]benzamide IUPAC Name: 3-chloro-4-ethoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide Traditional Name: 3-chloro-4-ethoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide Formula: C21H26ClN2O2+ MolecularWeight: 373.89634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3)Cl

InChI

InChI=1S/C21H25ClN2O2/c1-2-26-20-11-8-17(14-19(20)22)21(25)23-18-9-6-16(7-10-18)15-24-12-4-3-5-13-24/h6-11,14H,2-5,12-13,15H2,1H3,(H,23,25)/p+1