4-[2-[(1,5-dimethylindol-2-yl)carbonylamino]propanoylamino]butanoic acid

Systemtic Name: 4-[2-[(1,5-dimethylindol-2-yl)carbonylamino]propanoylamino]butanoic acid Openeye Name: 4-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]butanoic acid CAS Name: 4-[[2-[[(1,5-dimethyl-2-indolyl)-oxomethyl]amino]-1-oxopropyl]amino]butanoic acid IUPAC Name: 4-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]butanoic acid Traditional Name: 4-[2-[(1,5-dimethylindole-2-carbonyl)amino]propanoylamino]butyric acid Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(C)C(=O)NCCCC(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(C)C(=O)NCCCC(=O)O)C

InChI

InChI=1S/C18H23N3O4/c1-11-6-7-14-13(9-11)10-15(21(14)3)18(25)20-12(2)17(24)19-8-4-5-16(22)23/h6-7,9-10,12H,4-5,8H2,1-3H3,(H,19,24)(H,20,25)(H,22,23)