tert-butyl 4-(chloromethyl)-3-(3-methoxyphenyl)indole-1-carboxylate

Systemtic Name: tert-butyl 4-(chloromethyl)-3-(3-methoxyphenyl)indole-1-carboxylate Openeye Name: tert-butyl 4-(chloromethyl)-3-(3-methoxyphenyl)indole-1-carboxylate CAS Name: 4-(chloromethyl)-3-(3-methoxyphenyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(chloromethyl)-3-(3-methoxyphenyl)indole-1-carboxylate Traditional Name: 4-(chloromethyl)-3-(3-methoxyphenyl)indole-1-carboxylic acid tert-butyl ester Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C(C=CC=C21)CCl)C3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C(C=CC=C21)CCl)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H22ClNO3/c1-21(2,3)26-20(24)23-13-17(14-7-5-9-16(11-14)25-4)19-15(12-22)8-6-10-18(19)23/h5-11,13H,12H2,1-4H3