2-[(4-tert-butylphenyl)amino]-3-chloranyl-naphthalene-1,4-dione

Systemtic Name: 2-[(4-tert-butylphenyl)amino]-3-chloranyl-naphthalene-1,4-dione Openeye Name: 2-(4-tert-butylanilino)-3-chloro-naphthalene-1,4-dione CAS Name: 2-(4-tert-butylanilino)-3-chloronaphthalene-1,4-dione IUPAC Name: 2-(4-tert-butylanilino)-3-chloronaphthalene-1,4-dione Traditional Name: 2-(4-tert-butylanilino)-3-chloro-1,4-naphthoquinone Formula: C20H18ClNO2 MolecularWeight: 339.81542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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