2-[1-(pyridin-1-ium-4-ylmethylamino)ethylidene]indene-1,3-dione

Systemtic Name: 2-[1-(pyridin-1-ium-4-ylmethylamino)ethylidene]indene-1,3-dione Openeye Name: 2-[1-(pyridin-1-ium-4-ylmethylamino)ethylidene]indane-1,3-dione CAS Name: 2-[1-(4-pyridin-1-iumylmethylamino)ethylidene]indene-1,3-dione IUPAC Name: 2-[1-(pyridin-1-ium-4-ylmethylamino)ethylidene]indene-1,3-dione Traditional Name: 2-[1-(pyridin-1-ium-4-ylmethylamino)ethylidene]indane-1,3-quinone Formula: C17H15N2O2+ MolecularWeight: 279.3132

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)C2=CC=CC=C2C1=O)NCC3=CC=[NH+]C=C3

Isomeric SMILES

CC(=C1C(=O)C2=CC=CC=C2C1=O)NCC3=CC=[NH+]C=C3

InChI

InChI=1S/C17H14N2O2/c1-11(19-10-12-6-8-18-9-7-12)15-16(20)13-4-2-3-5-14(13)17(15)21/h2-9,19H,10H2,1H3/p+1