ethyl 4-[3-[8-[4-(2-methylpropyl)phenyl]undecanoyl]indol-1-yl]butanoate

Systemtic Name: ethyl 4-[3-[8-[4-(2-methylpropyl)phenyl]undecanoyl]indol-1-yl]butanoate Openeye Name: ethyl 4-[3-[8-(4-isobutylphenyl)undecanoyl]indol-1-yl]butanoate CAS Name: 4-[3-[8-[4-(2-methylpropyl)phenyl]-1-oxoundecyl]-1-indolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-[8-[4-(2-methylpropyl)phenyl]undecanoyl]indol-1-yl]butanoate Traditional Name: 4-[3-[8-(4-isobutylphenyl)undecanoyl]indol-1-yl]butyric acid ethyl ester Formula: C35H49NO3 MolecularWeight: 531.76846

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCCCCC(=O)C1=CN(C2=CC=CC=C21)CCCC(=O)OCC)C3=CC=C(C=C3)CC(C)C

Isomeric SMILES

CCCC(CCCCCCC(=O)C1=CN(C2=CC=CC=C21)CCCC(=O)OCC)C3=CC=C(C=C3)CC(C)C

InChI

InChI=1S/C35H49NO3/c1-5-14-29(30-22-20-28(21-23-30)25-27(3)4)15-9-7-8-10-18-34(37)32-26-36(24-13-19-35(38)39-6-2)33-17-12-11-16-31(32)33/h11-12,16-17,20-23,26-27,29H,5-10,13-15,18-19,24-25H2,1-4H3