3-[[(1-ethylpyrrolidin-2-yl)methylamino]methyl]-1-[(2-methylphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 3-[[(1-ethylpyrrolidin-2-yl)methylamino]methyl]-1-[(2-methylphenyl)methyl]indole-2-carboxylic acid Openeye Name: 3-[[(1-ethylpyrrolidin-2-yl)methylamino]methyl]-1-(o-tolylmethyl)indole-2-carboxylic acid CAS Name: 3-[[(1-ethyl-2-pyrrolidinyl)methylamino]methyl]-1-[(2-methylphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 3-[[(1-ethylpyrrolidin-2-yl)methylamino]methyl]-1-[(2-methylphenyl)methyl]indole-2-carboxylic acid Traditional Name: 3-[[(1-ethylpyrrolidin-2-yl)methylamino]methyl]-1-(2-methylbenzyl)indole-2-carboxylic acid Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNCC2=C(N(C3=CC=CC=C32)CC4=CC=CC=C4C)C(=O)O

Isomeric SMILES

CCN1CCCC1CNCC2=C(N(C3=CC=CC=C32)CC4=CC=CC=C4C)C(=O)O

InChI

InChI=1S/C25H31N3O2/c1-3-27-14-8-11-20(27)15-26-16-22-21-12-6-7-13-23(21)28(24(22)25(29)30)17-19-10-5-4-9-18(19)2/h4-7,9-10,12-13,20,26H,3,8,11,14-17H2,1-2H3,(H,29,30)