2-chloranyl-3-[[4-(10-methylsulfanyldecoxy)phenyl]amino]naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-[[4-(10-methylsulfanyldecoxy)phenyl]amino]naphthalene-1,4-dione Openeye Name: 2-chloro-3-[4-(10-methylsulfanyldecoxy)anilino]naphthalene-1,4-dione CAS Name: 2-chloro-3-[4-[10-(methylthio)decoxy]anilino]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-[4-(10-methylsulfanyldecoxy)anilino]naphthalene-1,4-dione Traditional Name: 2-chloro-3-[4-[10-(methylthio)decoxy]anilino]-1,4-naphthoquinone Formula: C27H32ClNO3S MolecularWeight: 486.06588

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCCCCCCCCOC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl

Isomeric SMILES

CSCCCCCCCCCCOC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl

InChI

InChI=1S/C27H32ClNO3S/c1-33-19-11-7-5-3-2-4-6-10-18-32-21-16-14-20(15-17-21)29-25-24(28)26(30)22-12-8-9-13-23(22)27(25)31/h8-9,12-17,29H,2-7,10-11,18-19H2,1H3