2-[1-(3-azanylpropyl)-4-oxidanylidene-quinolin-1-ium-1-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-(3-azanylpropyl)-4-oxidanylidene-quinolin-1-ium-1-yl]isoindole-1,3-dione Openeye Name: 2-[1-(3-aminopropyl)-4-oxo-quinolin-1-ium-1-yl]isoindoline-1,3-dione CAS Name: 2-[1-(3-aminopropyl)-4-oxo-1-quinolin-1-iumyl]isoindole-1,3-dione IUPAC Name: 2-[1-(3-aminopropyl)-4-oxoquinolin-1-ium-1-yl]isoindole-1,3-dione Traditional Name: 2-[1-(3-aminopropyl)-4-keto-quinolin-1-ium-1-yl]isoindoline-1,3-quinone Formula: C20H18N3O3+ MolecularWeight: 348.37522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)[N+]3(C=CC(=O)C4=CC=CC=C43)CCCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)[N+]3(C=CC(=O)C4=CC=CC=C43)CCCN

InChI

InChI=1S/C20H18N3O3/c21-11-5-12-23(13-10-18(24)16-8-3-4-9-17(16)23)22-19(25)14-6-1-2-7-15(14)20(22)26/h1-4,6-10,13H,5,11-12,21H2/q+1