[2-[1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-4-yl]oxy-4-methoxy-phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-[1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-4-yl]oxy-4-methoxy-phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [2-(1-indan-2-ylpiperidin-1-ium-4-yl)oxy-4-methoxy-phenyl]-pyrrolidin-1-yl-methanone CAS Name: [2-[[1-(2,3-dihydro-1H-inden-2-yl)-4-piperidin-1-iumyl]oxy]-4-methoxyphenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [2-[1-(2,3-dihydro-1H-inden-2-yl)piperidin-1-ium-4-yl]oxy-4-methoxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [2-(1-indan-2-ylpiperidin-1-ium-4-yl)oxy-4-methoxy-phenyl]-pyrrolidino-methanone Formula: C26H33N2O3+ MolecularWeight: 421.55182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CC[NH+](CC3)C4CC5=CC=CC=C5C4

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CC[NH+](CC3)C4CC5=CC=CC=C5C4

InChI

InChI=1S/C26H32N2O3/c1-30-23-8-9-24(26(29)28-12-4-5-13-28)25(18-23)31-22-10-14-27(15-11-22)21-16-19-6-2-3-7-20(19)17-21/h2-3,6-9,18,21-22H,4-5,10-17H2,1H3/p+1