4-[3-(5-bromanylindol-1-yl)propanoylamino]butanoate

Systemtic Name: 4-[3-(5-bromanylindol-1-yl)propanoylamino]butanoate Openeye Name: 4-[3-(5-bromoindol-1-yl)propanoylamino]butanoate CAS Name: 4-[[3-(5-bromo-1-indolyl)-1-oxopropyl]amino]butanoate IUPAC Name: 4-[3-(5-bromoindol-1-yl)propanoylamino]butanoate Traditional Name: 4-[3-(5-bromoindol-1-yl)propanoylamino]butyrate Formula: C15H16BrN2O3- MolecularWeight: 352.20314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN2CCC(=O)NCCCC(=O)[O-])C=C1Br

Isomeric SMILES

C1=CC2=C(C=CN2CCC(=O)NCCCC(=O)[O-])C=C1Br

InChI

InChI=1S/C15H17BrN2O3/c16-12-3-4-13-11(10-12)5-8-18(13)9-6-14(19)17-7-1-2-15(20)21/h3-5,8,10H,1-2,6-7,9H2,(H,17,19)(H,20,21)/p-1