tert-butyl 4-[[1-(4-chlorophenyl)-6-methoxy-2,3-dihydroindol-2-yl]methyl]benzoate

Systemtic Name: tert-butyl 4-[[1-(4-chlorophenyl)-6-methoxy-2,3-dihydroindol-2-yl]methyl]benzoate Openeye Name: tert-butyl 4-[[1-(4-chlorophenyl)-6-methoxy-indolin-2-yl]methyl]benzoate CAS Name: 4-[[1-(4-chlorophenyl)-6-methoxy-2,3-dihydroindol-2-yl]methyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[1-(4-chlorophenyl)-6-methoxy-2,3-dihydroindol-2-yl]methyl]benzoate Traditional Name: 4-[[1-(4-chlorophenyl)-6-methoxy-indolin-2-yl]methyl]benzoic acid tert-butyl ester Formula: C27H28ClNO3 MolecularWeight: 449.96912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)CC2CC3=C(N2C4=CC=C(C=C4)Cl)C=C(C=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)CC2CC3=C(N2C4=CC=C(C=C4)Cl)C=C(C=C3)OC

InChI

InChI=1S/C27H28ClNO3/c1-27(2,3)32-26(30)19-7-5-18(6-8-19)15-23-16-20-9-14-24(31-4)17-25(20)29(23)22-12-10-21(28)11-13-22/h5-14,17,23H,15-16H2,1-4H3