2-[(2-piperazine-1,4-diium-1-ylethylamino)methylidene]indene-1,3-dione

Systemtic Name: 2-[(2-piperazine-1,4-diium-1-ylethylamino)methylidene]indene-1,3-dione Openeye Name: 2-[(2-piperazine-1,4-diium-1-ylethylamino)methylene]indane-1,3-dione CAS Name: 2-[[2-(1-piperazine-1,4-diiumyl)ethylamino]methylidene]indene-1,3-dione IUPAC Name: 2-[(2-piperazine-1,4-diium-1-ylethylamino)methylidene]indene-1,3-dione Traditional Name: 2-[(2-piperazine-1,4-diium-1-ylethylamino)methylene]indane-1,3-quinone Formula: C16H21N3O2+2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCNC=C2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCNC=C2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H19N3O2/c20-15-12-3-1-2-4-13(12)16(21)14(15)11-18-7-10-19-8-5-17-6-9-19/h1-4,11,17-18H,5-10H2/p+2