methyl 2-[[3-cyclohexyl-2-(2-methoxyphenyl)-3-oxidanyl-propanoyl]amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[[3-cyclohexyl-2-(2-methoxyphenyl)-3-oxidanyl-propanoyl]amino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[[3-cyclohexyl-3-hydroxy-2-(2-methoxyphenyl)propanoyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[3-cyclohexyl-3-hydroxy-2-(2-methoxyphenyl)-1-oxopropyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[[3-cyclohexyl-3-hydroxy-2-(2-methoxyphenyl)propanoyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[[3-cyclohexyl-3-hydroxy-2-(2-methoxyphenyl)propanoyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C28H34N2O5 MolecularWeight: 478.57996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C(C2CCCCC2)O)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C(C(C2CCCCC2)O)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C28H34N2O5/c1-34-24-15-9-7-13-21(24)25(26(31)18-10-4-3-5-11-18)27(32)30-23(28(33)35-2)16-19-17-29-22-14-8-6-12-20(19)22/h6-9,12-15,17-18,23,25-26,29,31H,3-5,10-11,16H2,1-2H3,(H,30,32)