methyl 3-[[(2-hydroxyphenyl)amino]methyl]-1-(2-propylpentyl)indole-5-carboxylate

Systemtic Name: methyl 3-[[(2-hydroxyphenyl)amino]methyl]-1-(2-propylpentyl)indole-5-carboxylate Openeye Name: methyl 3-[(2-hydroxyanilino)methyl]-1-(2-propylpentyl)indole-5-carboxylate CAS Name: 3-[(2-hydroxyanilino)methyl]-1-(2-propylpentyl)-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-hydroxyanilino)methyl]-1-(2-propylpentyl)indole-5-carboxylate Traditional Name: 3-[(2-hydroxyanilino)methyl]-1-(2-propylpentyl)indole-5-carboxylic acid methyl ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNC3=CC=CC=C3O

Isomeric SMILES

CCCC(CCC)CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNC3=CC=CC=C3O

InChI

InChI=1S/C25H32N2O3/c1-4-8-18(9-5-2)16-27-17-20(15-26-22-10-6-7-11-24(22)28)21-14-19(25(29)30-3)12-13-23(21)27/h6-7,10-14,17-18,26,28H,4-5,8-9,15-16H2,1-3H3