tert-butyl 7-bromanyl-3-(2-dimethylaminoethyl)-4-phenylmethoxy-indole-1-carboxylate

Systemtic Name: tert-butyl 7-bromanyl-3-(2-dimethylaminoethyl)-4-phenylmethoxy-indole-1-carboxylate Openeye Name: tert-butyl 4-benzyloxy-7-bromo-3-(2-dimethylaminoethyl)indole-1-carboxylate CAS Name: 7-bromo-3-(2-dimethylaminoethyl)-4-phenylmethoxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-bromo-3-(2-dimethylaminoethyl)-4-phenylmethoxyindole-1-carboxylate Traditional Name: 4-benzoxy-7-bromo-3-(2-dimethylaminoethyl)indole-1-carboxylic acid tert-butyl ester Formula: C24H29BrN2O3 MolecularWeight: 473.40266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C(C=CC(=C21)Br)OCC3=CC=CC=C3)CCN(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C(C=CC(=C21)Br)OCC3=CC=CC=C3)CCN(C)C

InChI

InChI=1S/C24H29BrN2O3/c1-24(2,3)30-23(28)27-15-18(13-14-26(4)5)21-20(12-11-19(25)22(21)27)29-16-17-9-7-6-8-10-17/h6-12,15H,13-14,16H2,1-5H3