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

Systemtic Name: ethyl 3-[3-(4-aminocarbonylpiperidin-1-yl)propanoylamino]-5-bromanyl-1H-indole-2-carboxylate Openeye Name: ethyl 5-bromo-3-[3-(4-carbamoyl-1-piperidyl)propanoylamino]-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[[3-(4-carbamoyl-1-piperidinyl)-1-oxopropyl]amino]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-[3-(4-carbamoylpiperidin-1-yl)propanoylamino]-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-[3-(4-carbamoylpiperidino)propanoylamino]-1H-indole-2-carboxylic acid ethyl ester Formula: C20H25BrN4O4 MolecularWeight: 465.3409

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CCN3CCC(CC3)C(=O)N

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CCN3CCC(CC3)C(=O)N

InChI

InChI=1S/C20H25BrN4O4/c1-2-29-20(28)18-17(14-11-13(21)3-4-15(14)23-18)24-16(26)7-10-25-8-5-12(6-9-25)19(22)27/h3-4,11-12,23H,2,5-10H2,1H3,(H2,22,27)(H,24,26)