(2S)-2-[(1-nitroacridin-9-yl)amino]pentanedioic acid

Systemtic Name: (2S)-2-[(1-nitroacridin-9-yl)amino]pentanedioic acid Openeye Name: (2S)-2-[(1-nitroacridin-9-yl)amino]pentanedioic acid CAS Name: (2S)-2-[(1-nitro-9-acridinyl)amino]pentanedioic acid IUPAC Name: (2S)-2-[(1-nitroacridin-9-yl)amino]pentanedioic acid Traditional Name: (2S)-2-[(1-nitroacridin-9-yl)amino]glutaric acid Formula: C18H15N3O6 MolecularWeight: 369.3282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C(=N2)C=CC=C3[N+](=O)[O-])NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C(=N2)C=CC=C3[N+](=O)[O-])N[C@@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C18H15N3O6/c22-15(23)9-8-13(18(24)25)20-17-10-4-1-2-5-11(10)19-12-6-3-7-14(16(12)17)21(26)27/h1-7,13H,8-9H2,(H,19,20)(H,22,23)(H,24,25)/t13-/m0/s1