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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl

InChI

InChI=1S/C20H18ClNO2/c1-2-3-6-13-9-11-14(12-10-13)22-18-17(21)19(23)15-7-4-5-8-16(15)20(18)24/h4-5,7-12,22H,2-3,6H2,1H3