[2-[1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-[1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone Openeye Name: [2-[1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-yl-methanone CAS Name: [2-[[1-[(E)-2-methylbut-2-enyl]-4-piperidin-1-iumyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [2-[1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [2-[1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-yl]oxyphenyl]-pyrrolidino-methanone Formula: C21H31N2O2+ MolecularWeight: 343.48304

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C[NH+]1CCC(CC1)OC2=CC=CC=C2C(=O)N3CCCC3

Isomeric SMILES

C/C=C(\C)/C[NH+]1CCC(CC1)OC2=CC=CC=C2C(=O)N3CCCC3

InChI

InChI=1S/C21H30N2O2/c1-3-17(2)16-22-14-10-18(11-15-22)25-20-9-5-4-8-19(20)21(24)23-12-6-7-13-23/h3-5,8-9,18H,6-7,10-16H2,1-2H3/p+1/b17-3+