5-chloranyl-2-methoxy-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 5-chloranyl-2-methoxy-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 5-chloro-2-methoxy-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 5-chloro-2-methoxy-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 5-chloro-2-methoxy-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 5-chloro-2-methoxy-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C20H24ClN2O2+ MolecularWeight: 359.86976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3

InChI

InChI=1S/C20H23ClN2O2/c1-25-19-9-8-17(21)12-18(19)20(24)22-13-15-6-2-3-7-16(15)14-23-10-4-5-11-23/h2-3,6-9,12H,4-5,10-11,13-14H2,1H3,(H,22,24)/p+1