methyl 5-bromanyl-3-[2-(4-methylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate

Systemtic Name: methyl 5-bromanyl-3-[2-(4-methylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate Openeye Name: methyl 5-bromo-3-[2-(4-methyl-1-piperidyl)propanoylamino]-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[[2-(4-methyl-1-piperidinyl)-1-oxopropyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-[2-(4-methylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-[2-(4-methylpiperidino)propanoylamino]-1H-indole-2-carboxylic acid methyl ester Formula: C19H24BrN3O3 MolecularWeight: 422.31616

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(C)C(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CC1CCN(CC1)C(C)C(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C19H24BrN3O3/c1-11-6-8-23(9-7-11)12(2)18(24)22-16-14-10-13(20)4-5-15(14)21-17(16)19(25)26-3/h4-5,10-12,21H,6-9H2,1-3H3,(H,22,24)