1-isocyanato-2-methyl-anthracene-9,10-dione

Systemtic Name: 1-isocyanato-2-methyl-anthracene-9,10-dione Openeye Name: 1-isocyanato-2-methyl-anthracene-9,10-dione CAS Name: 1-isocyanato-2-methylanthracene-9,10-dione IUPAC Name: 1-isocyanato-2-methylanthracene-9,10-dione Traditional Name: 1-isocyanato-2-methyl-9,10-anthraquinone Formula: C16H9NO3 MolecularWeight: 263.24756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)N=C=O

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)N=C=O

InChI

InChI=1S/C16H9NO3/c1-9-6-7-12-13(14(9)17-8-18)16(20)11-5-3-2-4-10(11)15(12)19/h2-7H,1H3