2-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[(4,5-dibromothiophene-2-carbonyl)amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(4,5-dibromothiophene-2-carbonyl)amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[(4,5-dibromothiophene-2-carbonyl)amino]-3-(1H-indol-3-yl)propionic acid Formula: C16H12Br2N2O3S MolecularWeight: 472.15108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C3=CC(=C(S3)Br)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C3=CC(=C(S3)Br)Br

InChI

InChI=1S/C16H12Br2N2O3S/c17-10-6-13(24-14(10)18)15(21)20-12(16(22)23)5-8-7-19-11-4-2-1-3-9(8)11/h1-4,6-7,12,19H,5H2,(H,20,21)(H,22,23)