4-[4-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-3-methoxy-phenyl]carbonylpiperazin-2-one

Systemtic Name: 4-[4-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-3-methoxy-phenyl]carbonylpiperazin-2-one Openeye Name: 4-[4-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-3-methoxy-benzoyl]piperazin-2-one CAS Name: 4-[[4-[(1-cyclopentyl-4-piperidin-1-iumyl)oxy]-3-methoxyphenyl]-oxomethyl]-2-piperazinone IUPAC Name: 4-[4-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-3-methoxybenzoyl]piperazin-2-one Traditional Name: 4-[4-(1-cyclopentylpiperidin-1-ium-4-yl)oxy-3-methoxy-benzoyl]piperazin-2-one Formula: C22H32N3O4+ MolecularWeight: 402.50718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)N2CCNC(=O)C2)OC3CC[NH+](CC3)C4CCCC4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)N2CCNC(=O)C2)OC3CC[NH+](CC3)C4CCCC4

InChI

InChI=1S/C22H31N3O4/c1-28-20-14-16(22(27)25-13-10-23-21(26)15-25)6-7-19(20)29-18-8-11-24(12-9-18)17-4-2-3-5-17/h6-7,14,17-18H,2-5,8-13,15H2,1H3,(H,23,26)/p+1