2-piperidin-1-ium-1-ylethyl 9H-xanthene-9-carboxylate

Systemtic Name: 2-piperidin-1-ium-1-ylethyl 9H-xanthene-9-carboxylate Openeye Name: 2-piperidin-1-ium-1-ylethyl 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid 2-(1-piperidin-1-iumyl)ethyl ester IUPAC Name: 2-piperidin-1-ium-1-ylethyl 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid 2-piperidin-1-ium-1-ylethyl ester Formula: C21H24NO3+ MolecularWeight: 338.42016

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCOC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

C1CC[NH+](CC1)CCOC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C21H23NO3/c23-21(24-15-14-22-12-6-1-7-13-22)20-16-8-2-4-10-18(16)25-19-11-5-3-9-17(19)20/h2-5,8-11,20H,1,6-7,12-15H2/p+1