ethyl 5,5-dimethyl-3-(6-phenylmethoxy-1H-indol-3-yl)hexanoate

Systemtic Name: ethyl 5,5-dimethyl-3-(6-phenylmethoxy-1H-indol-3-yl)hexanoate Openeye Name: ethyl 3-(6-benzyloxy-1H-indol-3-yl)-5,5-dimethyl-hexanoate CAS Name: 5,5-dimethyl-3-(6-phenylmethoxy-1H-indol-3-yl)hexanoic acid ethyl ester IUPAC Name: ethyl 5,5-dimethyl-3-(6-phenylmethoxy-1H-indol-3-yl)hexanoate Traditional Name: 3-(6-benzoxy-1H-indol-3-yl)-5,5-dimethyl-hexanoic acid ethyl ester Formula: C25H31NO3 MolecularWeight: 393.51854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC(C)(C)C)C1=CNC2=C1C=CC(=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(CC(C)(C)C)C1=CNC2=C1C=CC(=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H31NO3/c1-5-28-24(27)13-19(15-25(2,3)4)22-16-26-23-14-20(11-12-21(22)23)29-17-18-9-7-6-8-10-18/h6-12,14,16,19,26H,5,13,15,17H2,1-4H3