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

Systemtic Name: methyl 1-[2-(2-hydroxyphenyl)-4-methyl-pentyl]-3-[[(phenylmethyl)amino]methyl]indole-5-carboxylate Openeye Name: methyl 3-[(benzylamino)methyl]-1-[2-(2-hydroxyphenyl)-4-methyl-pentyl]indole-5-carboxylate CAS Name: 1-[2-(2-hydroxyphenyl)-4-methylpentyl]-3-[[(phenylmethyl)amino]methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(benzylamino)methyl]-1-[2-(2-hydroxyphenyl)-4-methylpentyl]indole-5-carboxylate Traditional Name: 3-[(benzylamino)methyl]-1-[2-(2-hydroxyphenyl)-4-methyl-pentyl]indole-5-carboxylic acid methyl ester Formula: C30H34N2O3 MolecularWeight: 470.60256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNCC3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

CC(C)CC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNCC3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C30H34N2O3/c1-21(2)15-24(26-11-7-8-12-29(26)33)19-32-20-25(18-31-17-22-9-5-4-6-10-22)27-16-23(30(34)35-3)13-14-28(27)32/h4-14,16,20-21,24,31,33H,15,17-19H2,1-3H3