ethyl 5-bromanyl-3-(3,3-diphenylpropanoylamino)-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-(3,3-diphenylpropanoylamino)-1H-indole-2-carboxylate Openeye Name: ethyl 5-bromo-3-(3,3-diphenylpropanoylamino)-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[(1-oxo-3,3-diphenylpropyl)amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-(3,3-diphenylpropanoylamino)-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-(3,3-diphenylpropanoylamino)-1H-indole-2-carboxylic acid ethyl ester Formula: C26H23BrN2O3 MolecularWeight: 491.37642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H23BrN2O3/c1-2-32-26(31)25-24(21-15-19(27)13-14-22(21)28-25)29-23(30)16-20(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-15,20,28H,2,16H2,1H3,(H,29,30)