ethyl 2-methyl-5-[2-oxidanyl-3-[(phenylmethyl)amino]propoxy]-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-[2-oxidanyl-3-[(phenylmethyl)amino]propoxy]-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 5-[3-(benzylamino)-2-hydroxy-propoxy]-2-methyl-1-phenyl-indole-3-carboxylate CAS Name: 5-[2-hydroxy-3-[(phenylmethyl)amino]propoxy]-2-methyl-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(benzylamino)-2-hydroxypropoxy]-2-methyl-1-phenylindole-3-carboxylate Traditional Name: 5-[3-(benzylamino)-2-hydroxy-propoxy]-2-methyl-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C28H30N2O4 MolecularWeight: 458.5488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CNCC3=CC=CC=C3)O)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CNCC3=CC=CC=C3)O)C4=CC=CC=C4)C

InChI

InChI=1S/C28H30N2O4/c1-3-33-28(32)27-20(2)30(22-12-8-5-9-13-22)26-15-14-24(16-25(26)27)34-19-23(31)18-29-17-21-10-6-4-7-11-21/h4-16,23,29,31H,3,17-19H2,1-2H3