tert-butyl 2-[1-(4-chlorophenyl)carbonyl-2-methyl-5-(3-phenylmethoxypropoxy)indol-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[1-(4-chlorophenyl)carbonyl-2-methyl-5-(3-phenylmethoxypropoxy)indol-3-yl]ethanoate Openeye Name: tert-butyl 2-[5-(3-benzyloxypropoxy)-1-(4-chlorobenzoyl)-2-methyl-indol-3-yl]acetate CAS Name: 2-[1-[(4-chlorophenyl)-oxomethyl]-2-methyl-5-(3-phenylmethoxypropoxy)-3-indolyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-(4-chlorobenzoyl)-2-methyl-5-(3-phenylmethoxypropoxy)indol-3-yl]acetate Traditional Name: 2-[5-(3-benzoxypropoxy)-1-(4-chlorobenzoyl)-2-methyl-indol-3-yl]acetic acid tert-butyl ester Formula: C32H34ClNO5 MolecularWeight: 548.06906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OCCCOCC4=CC=CC=C4)CC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OCCCOCC4=CC=CC=C4)CC(=O)OC(C)(C)C

InChI

InChI=1S/C32H34ClNO5/c1-22-27(20-30(35)39-32(2,3)4)28-19-26(38-18-8-17-37-21-23-9-6-5-7-10-23)15-16-29(28)34(22)31(36)24-11-13-25(33)14-12-24/h5-7,9-16,19H,8,17-18,20-21H2,1-4H3