[1-(cyclopropylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-bromanyl-1H-indole-2-carboxylate

Systemtic Name: [1-(cyclopropylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-bromanyl-1H-indole-2-carboxylate Openeye Name: [2-(cyclopropylcarbamoylamino)-1-methyl-2-oxo-ethyl] 3-bromo-1H-indole-2-carboxylate CAS Name: 3-bromo-1H-indole-2-carboxylic acid [1-[[(cyclopropylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopropylcarbamoylamino)-1-oxopropan-2-yl] 3-bromo-1H-indole-2-carboxylate Traditional Name: 3-bromo-1H-indole-2-carboxylic acid [2-(cyclopropylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H16BrN3O4 MolecularWeight: 394.21994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)OC(=O)C2=C(C3=CC=CC=C3N2)Br

Isomeric SMILES

CC(C(=O)NC(=O)NC1CC1)OC(=O)C2=C(C3=CC=CC=C3N2)Br

InChI

InChI=1S/C16H16BrN3O4/c1-8(14(21)20-16(23)18-9-6-7-9)24-15(22)13-12(17)10-4-2-3-5-11(10)19-13/h2-5,8-9,19H,6-7H2,1H3,(H2,18,20,21,23)