2-(acridin-9-ylcarbonylamino)-3-sulfanyl-propanoic acid

Systemtic Name: 2-(acridin-9-ylcarbonylamino)-3-sulfanyl-propanoic acid Openeye Name: 2-(acridine-9-carbonylamino)-3-sulfanyl-propanoic acid CAS Name: 2-[[9-acridinyl(oxo)methyl]amino]-3-mercaptopropanoic acid IUPAC Name: 2-(acridine-9-carbonylamino)-3-sulfanylpropanoic acid Traditional Name: 2-(acridine-9-carbonylamino)-3-mercapto-propionic acid Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C(=O)NC(CS)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)C(=O)NC(CS)C(=O)O

InChI

InChI=1S/C17H14N2O3S/c20-16(19-14(9-23)17(21)22)15-10-5-1-3-7-12(10)18-13-8-4-2-6-11(13)15/h1-8,14,23H,9H2,(H,19,20)(H,21,22)