2-chloranyl-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]naphthalene-1,4-dione Openeye Name: 2-chloro-3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]naphthalene-1,4-dione CAS Name: 2-chloro-3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]naphthalene-1,4-dione Traditional Name: 2-chloro-3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-1,4-naphthoquinone Formula: C21H16ClN3O3 MolecularWeight: 393.82304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C(C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C(C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C21H16ClN3O3/c1-12-17(21(28)25(24(12)2)13-8-4-3-5-9-13)23-18-16(22)19(26)14-10-6-7-11-15(14)20(18)27/h3-11,23H,1-2H3