4-(phenoxymethyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide

Systemtic Name: 4-(phenoxymethyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Openeye Name: 4-(phenoxymethyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide CAS Name: 4-(phenoxymethyl)-N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]benzamide IUPAC Name: 4-(phenoxymethyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Traditional Name: 4-(phenoxymethyl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Formula: C25H27N2O2+ MolecularWeight: 387.49408

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)COC4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)COC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O2/c28-25(26-23-14-10-20(11-15-23)18-27-16-4-5-17-27)22-12-8-21(9-13-22)19-29-24-6-2-1-3-7-24/h1-3,6-15H,4-5,16-19H2,(H,26,28)/p+1