3-[(4-ethylpiperazin-4-ium-1-yl)methylidene]chromene-2,4-dione

Systemtic Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methylidene]chromene-2,4-dione Openeye Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methylene]chromane-2,4-dione CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)methylidene]-3,4-dihydro-2H-1-benzopyran-2,4-dione IUPAC Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methylidene]chromene-2,4-dione Traditional Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methylene]chroman-2,4-quinone Formula: C16H19N2O3+ MolecularWeight: 287.33366

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C=C2C(=O)C3=CC=CC=C3OC2=O

Isomeric SMILES

CC[NH+]1CCN(CC1)C=C2C(=O)C3=CC=CC=C3OC2=O

InChI

InChI=1S/C16H18N2O3/c1-2-17-7-9-18(10-8-17)11-13-15(19)12-5-3-4-6-14(12)21-16(13)20/h3-6,11H,2,7-10H2,1H3/p+1