4-[(cyclopentylamino)methyl]-2,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylic acid

Systemtic Name: 4-[(cyclopentylamino)methyl]-2,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxylic acid Openeye Name: 1-benzyl-4-[(cyclopentylamino)methyl]-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 4-[(cyclopentylamino)methyl]-2,5-dimethyl-1-(phenylmethyl)-3-pyrrolecarboxylic acid IUPAC Name: 1-benzyl-4-[(cyclopentylamino)methyl]-2,5-dimethylpyrrole-3-carboxylic acid Traditional Name: 1-benzyl-4-[(cyclopentylamino)methyl]-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)O)CNC3CCCC3

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=CC=C2)C)C(=O)O)CNC3CCCC3

InChI

InChI=1S/C20H26N2O2/c1-14-18(12-21-17-10-6-7-11-17)19(20(23)24)15(2)22(14)13-16-8-4-3-5-9-16/h3-5,8-9,17,21H,6-7,10-13H2,1-2H3,(H,23,24)