methane; [4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]-phenyl-methanone; chloride

Systemtic Name: methane; [4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]-phenyl-methanone; chloride Openeye Name: methane; [4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]-phenyl-methanone; chloride CAS Name: methane; [4-methoxy-3-(1-piperidin-1-iumylmethyl)phenyl]-phenylmethanone; chloride IUPAC Name: methane; [4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]-phenylmethanone; chloride Traditional Name: methane; [4-methoxy-3-(piperidin-1-ium-1-ylmethyl)phenyl]-phenyl-methanone; chloride Formula: C21H28ClNO2 MolecularWeight: 361.90552

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Descriptors Computed from Structure

Canonical SMILES:

C.COC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)C[NH+]3CCCCC3.[Cl-]

Isomeric SMILES

C.COC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)C[NH+]3CCCCC3.[Cl-]

InChI

InChI=1S/C20H23NO2.CH4.ClH/c1-23-19-11-10-17(20(22)16-8-4-2-5-9-16)14-18(19)15-21-12-6-3-7-13-21;;/h2,4-5,8-11,14H,3,6-7,12-13,15H2,1H3;1H4;1H