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

Systemtic Name: methyl 5-bromanyl-3-[2-(4-ethoxycarbonylpiperidin-1-yl)ethanoylamino]-1H-indole-2-carboxylate Openeye Name: methyl 5-bromo-3-[[2-(4-ethoxycarbonyl-1-piperidyl)acetyl]amino]-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[[2-(4-ethoxycarbonyl-1-piperidinyl)-1-oxoethyl]amino]-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-bromo-3-[[2-(4-ethoxycarbonylpiperidin-1-yl)acetyl]amino]-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-[[2-(4-carbethoxypiperidino)acetyl]amino]-1H-indole-2-carboxylic acid methyl ester Formula: C20H24BrN3O5 MolecularWeight: 466.32566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)OC

InChI

InChI=1S/C20H24BrN3O5/c1-3-29-19(26)12-6-8-24(9-7-12)11-16(25)23-17-14-10-13(21)4-5-15(14)22-18(17)20(27)28-2/h4-5,10,12,22H,3,6-9,11H2,1-2H3,(H,23,25)