methyl 5-bromanyl-3-(propan-2-ylcarbamoylamino)-1H-indole-2-carboxylate

Systemtic Name: methyl 5-bromanyl-3-(propan-2-ylcarbamoylamino)-1H-indole-2-carboxylate Openeye Name: methyl 5-bromo-3-(isopropylcarbamoylamino)-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[[oxo-(propan-2-ylamino)methyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-(propan-2-ylcarbamoylamino)-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-(isopropylcarbamoylamino)-1H-indole-2-carboxylic acid methyl ester Formula: C14H16BrN3O3 MolecularWeight: 354.19914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=C(NC2=C1C=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC(C)NC(=O)NC1=C(NC2=C1C=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C14H16BrN3O3/c1-7(2)16-14(20)18-11-9-6-8(15)4-5-10(9)17-12(11)13(19)21-3/h4-7,17H,1-3H3,(H2,16,18,20)