methyl 1-(2-ethyl-4-methyl-pentyl)-3-[[(2-hydroxyphenyl)amino]methyl]indole-5-carboxylate

Systemtic Name: methyl 1-(2-ethyl-4-methyl-pentyl)-3-[[(2-hydroxyphenyl)amino]methyl]indole-5-carboxylate Openeye Name: methyl 1-(2-ethyl-4-methyl-pentyl)-3-[(2-hydroxyanilino)methyl]indole-5-carboxylate CAS Name: 1-(2-ethyl-4-methylpentyl)-3-[(2-hydroxyanilino)methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-ethyl-4-methylpentyl)-3-[(2-hydroxyanilino)methyl]indole-5-carboxylate Traditional Name: 1-(2-ethyl-4-methyl-pentyl)-3-[(2-hydroxyanilino)methyl]indole-5-carboxylic acid methyl ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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