4-butoxy-3-methoxy-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 4-butoxy-3-methoxy-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-butoxy-3-methoxy-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-butoxy-3-methoxy-N-[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-butoxy-3-methoxy-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-butoxy-3-methoxy-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C25H35N2O4+ MolecularWeight: 427.5564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NCC(C2=CC(=CC=C2)OC)[NH+]3CCCC3)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC[C@@H](C2=CC(=CC=C2)OC)[NH+]3CCCC3)OC

InChI

InChI=1S/C25H34N2O4/c1-4-5-15-31-23-12-11-20(17-24(23)30-3)25(28)26-18-22(27-13-6-7-14-27)19-9-8-10-21(16-19)29-2/h8-12,16-17,22H,4-7,13-15,18H2,1-3H3,(H,26,28)/p+1/t22-/m0/s1