5-azanyl-2-[(10-oxidanidylacridin-10-ium-9-yl)methylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[(10-oxidanidylacridin-10-ium-9-yl)methylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(10-oxidoacridin-10-ium-9-yl)methylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[(10-oxido-9-acridin-10-iumyl)methylamino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(10-oxidoacridin-10-ium-9-yl)methylamino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-[(10-oxidoacridin-10-ium-9-yl)methylamino]valeric acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[N+]2[O-])CNC(CCC(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[N+]2[O-])CNC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C19H19N3O4/c20-18(23)10-9-15(19(24)25)21-11-14-12-5-1-3-7-16(12)22(26)17-8-4-2-6-13(14)17/h1-8,15,21H,9-11H2,(H2,20,23)(H,24,25)