(1-butylpyrrolidin-3-yl) 9H-xanthene-9-carboxylate hydrochloride

Systemtic Name: (1-butylpyrrolidin-3-yl) 9H-xanthene-9-carboxylate hydrochloride Openeye Name: (1-butylpyrrolidin-3-yl) 9H-xanthene-9-carboxylate hydrochloride CAS Name: 9H-xanthene-9-carboxylic acid (1-butyl-3-pyrrolidinyl) ester hydrochloride IUPAC Name: (1-butylpyrrolidin-3-yl) 9H-xanthene-9-carboxylate hydrochloride Traditional Name: 9H-xanthene-9-carboxylic acid (1-butylpyrrolidin-3-yl) ester hydrochloride Formula: C22H26ClNO3 MolecularWeight: 387.89974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(C1)OC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24.Cl

Isomeric SMILES

CCCCN1CCC(C1)OC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24.Cl

InChI

InChI=1S/C22H25NO3.ClH/c1-2-3-13-23-14-12-16(15-23)25-22(24)21-17-8-4-6-10-19(17)26-20-11-7-5-9-18(20)21;/h4-11,16,21H,2-3,12-15H2,1H3;1H