methyl 3-(ethylaminomethyl)-1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]indole-5-carboxylate

Systemtic Name: methyl 3-(ethylaminomethyl)-1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]indole-5-carboxylate Openeye Name: methyl 3-(ethylaminomethyl)-1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]indole-5-carboxylate CAS Name: 3-(ethylaminomethyl)-1-[2-(2-hydroxyphenyl)-2-phenylethyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(ethylaminomethyl)-1-[2-(2-hydroxyphenyl)-2-phenylethyl]indole-5-carboxylate Traditional Name: 3-(ethylaminomethyl)-1-[2-(2-hydroxyphenyl)-2-phenyl-ethyl]indole-5-carboxylic acid methyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(C3=CC=CC=C3)C4=CC=CC=C4O

Isomeric SMILES

CCNCC1=CN(C2=C1C=C(C=C2)C(=O)OC)CC(C3=CC=CC=C3)C4=CC=CC=C4O

InChI

InChI=1S/C27H28N2O3/c1-3-28-16-21-17-29(25-14-13-20(15-23(21)25)27(31)32-2)18-24(19-9-5-4-6-10-19)22-11-7-8-12-26(22)30/h4-15,17,24,28,30H,3,16,18H2,1-2H3