methyl 5-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl-(2-piperidin-1-ium-1-ylethyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl-(2-piperidin-1-ium-1-ylethyl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl-(2-piperidin-1-ium-1-ylethyl)amino]-5-oxo-pentanoate CAS Name: 5-[[(3R)-1-cyclopentyl-3-piperidin-1-iumyl]methyl-[2-(1-piperidin-1-iumyl)ethyl]amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl-(2-piperidin-1-ium-1-ylethyl)amino]-5-oxopentanoate Traditional Name: 5-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl-(2-piperidin-1-ium-1-ylethyl)amino]-5-keto-valeric acid methyl ester Formula: C24H45N3O3+2 MolecularWeight: 423.6324

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)N(CC[NH+]1CCCCC1)CC2CCC[NH+](C2)C3CCCC3

Isomeric SMILES

COC(=O)CCCC(=O)N(CC[NH+]1CCCCC1)C[C@H]2CCC[NH+](C2)C3CCCC3

InChI

InChI=1S/C24H43N3O3/c1-30-24(29)13-7-12-23(28)27(18-17-25-14-5-2-6-15-25)20-21-9-8-16-26(19-21)22-10-3-4-11-22/h21-22H,2-20H2,1H3/p+2/t21-/m0/s1