2-(9-oxidanylideneacridin-10-yl)ethanoate; trimethyl(2-oxidaniumylethyl)azanium

Systemtic Name: 2-(9-oxidanylideneacridin-10-yl)ethanoate; trimethyl(2-oxidaniumylethyl)azanium Openeye Name: 2-(9-oxoacridin-10-yl)acetate; trimethyl(2-oxonioethyl)ammonium CAS Name: 2-(9-oxo-10-acridinyl)acetate; trimethyl(2-oxonioethyl)ammonium IUPAC Name: 2-(9-oxoacridin-10-yl)acetate; trimethyl(2-oxonioethyl)azanium Traditional Name: 2-(9-ketoacridin-10-yl)acetate; trimethyl(2-oxonioethyl)ammonium Formula: C35H35N3O7 MolecularWeight: 609.6683

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC[OH2+].C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)[O-].C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)[O-]

Isomeric SMILES

C[N+](C)(C)CC[OH2+].C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)[O-].C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3N2CC(=O)[O-]

InChI

InChI=1S/2C15H11NO3.C5H14NO/c2*17-14(18)9-16-12-7-3-1-5-10(12)15(19)11-6-2-4-8-13(11)16;1-6(2,3)4-5-7/h2*1-8H,9H2,(H,17,18);7H,4-5H2,1-3H3/q;;+1/p-1