2-(1-azanyl-3-bromanyl-2-oxidanylidene-propyl)-4-[(1,3-dimethylindol-2-yl)carbonylamino]-5-methyl-3-oxidanylidene-hexanoic acid

Systemtic Name: 2-(1-azanyl-3-bromanyl-2-oxidanylidene-propyl)-4-[(1,3-dimethylindol-2-yl)carbonylamino]-5-methyl-3-oxidanylidene-hexanoic acid Openeye Name: 2-(1-amino-3-bromo-2-oxo-propyl)-4-[(1,3-dimethylindole-2-carbonyl)amino]-5-methyl-3-oxo-hexanoic acid CAS Name: 2-(1-amino-3-bromo-2-oxopropyl)-4-[[(1,3-dimethyl-2-indolyl)-oxomethyl]amino]-5-methyl-3-oxohexanoic acid IUPAC Name: 2-(1-amino-3-bromo-2-oxopropyl)-4-[(1,3-dimethylindole-2-carbonyl)amino]-5-methyl-3-oxohexanoic acid Traditional Name: 2-(1-amino-3-bromo-2-keto-propyl)-4-[(1,3-dimethylindole-2-carbonyl)amino]-3-keto-5-methyl-hexanoic acid Formula: C21H26BrN3O5 MolecularWeight: 480.35224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C12)C)C(=O)NC(C(C)C)C(=O)C(C(C(=O)CBr)N)C(=O)O

Isomeric SMILES

CC1=C(N(C2=CC=CC=C12)C)C(=O)NC(C(C)C)C(=O)C(C(C(=O)CBr)N)C(=O)O

InChI

InChI=1S/C21H26BrN3O5/c1-10(2)17(19(27)15(21(29)30)16(23)14(26)9-22)24-20(28)18-11(3)12-7-5-6-8-13(12)25(18)4/h5-8,10,15-17H,9,23H2,1-4H3,(H,24,28)(H,29,30)