(phenylmethyl) 5-bromanyl-3-(3-chloranyl-2-oxidanylidene-propyl)indole-1-carboxylate

Systemtic Name: (phenylmethyl) 5-bromanyl-3-(3-chloranyl-2-oxidanylidene-propyl)indole-1-carboxylate Openeye Name: benzyl 5-bromo-3-(3-chloro-2-oxo-propyl)indole-1-carboxylate CAS Name: 5-bromo-3-(3-chloro-2-oxopropyl)-1-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-bromo-3-(3-chloro-2-oxopropyl)indole-1-carboxylate Traditional Name: 5-bromo-3-(3-chloro-2-keto-propyl)indole-1-carboxylic acid benzyl ester Formula: C19H15BrClNO3 MolecularWeight: 420.6843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N2C=C(C3=C2C=CC(=C3)Br)CC(=O)CCl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N2C=C(C3=C2C=CC(=C3)Br)CC(=O)CCl

InChI

InChI=1S/C19H15BrClNO3/c20-15-6-7-18-17(9-15)14(8-16(23)10-21)11-22(18)19(24)25-12-13-4-2-1-3-5-13/h1-7,9,11H,8,10,12H2