methyl 2-[[1-(2-chloranyl-2-oxidanylidene-ethanoyl)-3-(cyclohexylmethyl)-2-methyl-indolizin-8-yl]-phenylmethoxycarbonyl-amino]ethanoate

Systemtic Name: methyl 2-[[1-(2-chloranyl-2-oxidanylidene-ethanoyl)-3-(cyclohexylmethyl)-2-methyl-indolizin-8-yl]-phenylmethoxycarbonyl-amino]ethanoate Openeye Name: methyl 2-[benzyloxycarbonyl-[1-(2-chloro-2-oxo-acetyl)-3-(cyclohexylmethyl)-2-methyl-indolizin-8-yl]amino]acetate CAS Name: 2-[[1-(2-chloro-1,2-dioxoethyl)-3-(cyclohexylmethyl)-2-methyl-8-indolizinyl]-phenylmethoxycarbonylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[1-(2-chloro-2-oxoacetyl)-3-(cyclohexylmethyl)-2-methylindolizin-8-yl]-phenylmethoxycarbonylamino]acetate Traditional Name: 2-[carbobenzoxy-[1-(2-chloro-2-keto-acetyl)-3-(cyclohexylmethyl)-2-methyl-indolizin-8-yl]amino]acetic acid methyl ester Formula: C29H31ClN2O6 MolecularWeight: 539.01924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=CC=C(C2=C1C(=O)C(=O)Cl)N(CC(=O)OC)C(=O)OCC3=CC=CC=C3)CC4CCCCC4

Isomeric SMILES

CC1=C(N2C=CC=C(C2=C1C(=O)C(=O)Cl)N(CC(=O)OC)C(=O)OCC3=CC=CC=C3)CC4CCCCC4

InChI

InChI=1S/C29H31ClN2O6/c1-19-23(16-20-10-5-3-6-11-20)31-15-9-14-22(26(31)25(19)27(34)28(30)35)32(17-24(33)37-2)29(36)38-18-21-12-7-4-8-13-21/h4,7-9,12-15,20H,3,5-6,10-11,16-18H2,1-2H3