4-(acridin-10-ium-9-ylamino)butanoate

Systemtic Name: 4-(acridin-10-ium-9-ylamino)butanoate Openeye Name: 4-(acridin-10-ium-9-ylamino)butanoate CAS Name: 4-(9-acridin-10-iumylamino)butanoate IUPAC Name: 4-(acridin-10-ium-9-ylamino)butanoate Traditional Name: 4-(acridin-10-ium-9-ylamino)butyrate Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[NH+]2)NCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[NH+]2)NCCCC(=O)[O-]

InChI

InChI=1S/C17H16N2O2/c20-16(21)10-5-11-18-17-12-6-1-3-8-14(12)19-15-9-4-2-7-13(15)17/h1-4,6-9H,5,10-11H2,(H,18,19)(H,20,21)