ethyl 2-methyl-5-oxidanyl-1-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]indole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-oxidanyl-1-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]indole-3-carboxylate Openeye Name: ethyl 5-hydroxy-2-methyl-1-[2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]ethyl]indole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-1-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-methyl-1-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]indole-3-carboxylate Traditional Name: 1-[2-(4-cumylphenoxy)ethyl]-5-hydroxy-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C29H31NO4 MolecularWeight: 457.56074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CCOC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)CCOC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4)C

InChI

InChI=1S/C29H31NO4/c1-5-33-28(32)27-20(2)30(26-16-13-23(31)19-25(26)27)17-18-34-24-14-11-22(12-15-24)29(3,4)21-9-7-6-8-10-21/h6-16,19,31H,5,17-18H2,1-4H3