1-(4-naphthalen-2-ylbutanoyl)-1-octyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ium-2-carboxylate

Systemtic Name: 1-(4-naphthalen-2-ylbutanoyl)-1-octyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ium-2-carboxylate Openeye Name: 1-[4-(2-naphthyl)butanoyl]-1-octyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ium-2-carboxylate CAS Name: 1-[4-(2-naphthalenyl)-1-oxobutyl]-1-octyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ium-2-carboxylate IUPAC Name: 1-(4-naphthalen-2-ylbutanoyl)-1-octyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ium-2-carboxylate Traditional Name: 1-[4-(2-naphthyl)butanoyl]-1-octyl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ium-2-carboxylate Formula: C30H41NO3 MolecularWeight: 463.65144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+]1(C2CCCC2CC1C(=O)[O-])C(=O)CCCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCCCCC[N+]1(C2CCCC2CC1C(=O)[O-])C(=O)CCCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C30H41NO3/c1-2-3-4-5-6-9-20-31(27-16-11-15-26(27)22-28(31)30(33)34)29(32)17-10-12-23-18-19-24-13-7-8-14-25(24)21-23/h7-8,13-14,18-19,21,26-28H,2-6,9-12,15-17,20,22H2,1H3