N,N-dibutylmethanamide; 4-(2,3-dihydro-1H-inden-5-yl)-2-(4-ethylphenyl)-1-methyl-pyrrolidine-3-carboxylic acid

Systemtic Name: N,N-dibutylmethanamide; 4-(2,3-dihydro-1H-inden-5-yl)-2-(4-ethylphenyl)-1-methyl-pyrrolidine-3-carboxylic acid Openeye Name: N,N-dibutylformamide; 2-(4-ethylphenyl)-4-indan-5-yl-1-methyl-pyrrolidine-3-carboxylic acid CAS Name: N,N-dibutylformamide; 4-(2,3-dihydro-1H-inden-5-yl)-2-(4-ethylphenyl)-1-methyl-3-pyrrolidinecarboxylic acid IUPAC Name: N,N-dibutylformamide; 4-(2,3-dihydro-1H-inden-5-yl)-2-(4-ethylphenyl)-1-methylpyrrolidine-3-carboxylic acid Traditional Name: N,N-dibutylformamide; 2-(4-ethylphenyl)-4-indan-5-yl-1-methyl-pyrrolidine-3-carboxylic acid Formula: C32H46N2O3 MolecularWeight: 506.71924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C=O.CCC1=CC=C(C=C1)C2C(C(CN2C)C3=CC4=C(CCC4)C=C3)C(=O)O

Isomeric SMILES

CCCCN(CCCC)C=O.CCC1=CC=C(C=C1)C2C(C(CN2C)C3=CC4=C(CCC4)C=C3)C(=O)O

InChI

InChI=1S/C23H27NO2.C9H19NO/c1-3-15-7-9-17(10-8-15)22-21(23(25)26)20(14-24(22)2)19-12-11-16-5-4-6-18(16)13-19;1-3-5-7-10(9-11)8-6-4-2/h7-13,20-22H,3-6,14H2,1-2H3,(H,25,26);9H,3-8H2,1-2H3