2-chloranyl-3-[(3-methyl-4-propan-2-yl-phenyl)amino]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[(3-methyl-4-propan-2-yl-phenyl)amino]naphthalene-1,4-dione Openeye Name: 2-chloro-3-(4-isopropyl-3-methyl-anilino)naphthalene-1,4-dione CAS Name: 2-chloro-3-(3-methyl-4-propan-2-ylanilino)naphthalene-1,4-dione IUPAC Name: 2-chloro-3-(3-methyl-4-propan-2-ylanilino)naphthalene-1,4-dione Traditional Name: 2-chloro-3-(4-isopropyl-3-methyl-anilino)-1,4-naphthoquinone Formula: C20H18ClNO2 MolecularWeight: 339.81542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl)C(C)C

InChI

InChI=1S/C20H18ClNO2/c1-11(2)14-9-8-13(10-12(14)3)22-18-17(21)19(23)15-6-4-5-7-16(15)20(18)24/h4-11,22H,1-3H3