N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-[3-methoxy-4-(2-oxo-1-pyrrolidinyl)phenyl]-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-[4-(2-ketopyrrolidino)-3-methoxy-phenyl]-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3)N4CCCC4=O

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3)N4CCCC4=O

InChI

InChI=1S/C24H29N3O3/c1-30-22-16-20(11-12-21(22)27-15-5-6-23(27)28)25-24(29)19-9-7-18(8-10-19)17-26-13-3-2-4-14-26/h7-12,16H,2-6,13-15,17H2,1H3,(H,25,29)/p+1