2-[[4-[(2S)-butan-2-yl]oxy-3-chloranyl-phenyl]methylidene]indene-1,3-dione

Systemtic Name: 2-[[4-[(2S)-butan-2-yl]oxy-3-chloranyl-phenyl]methylidene]indene-1,3-dione Openeye Name: 2-[[3-chloro-4-[(1S)-1-methylpropoxy]phenyl]methylene]indane-1,3-dione CAS Name: 2-[[4-[(2S)-butan-2-yl]oxy-3-chlorophenyl]methylidene]indene-1,3-dione IUPAC Name: 2-[[4-[(2S)-butan-2-yl]oxy-3-chlorophenyl]methylidene]indene-1,3-dione Traditional Name: 2-[3-chloro-4-[(1S)-1-methylpropoxy]benzylidene]indane-1,3-quinone Formula: C20H17ClO3 MolecularWeight: 340.80018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1)C=C2C(=O)C3=CC=CC=C3C2=O)Cl

Isomeric SMILES

CC[C@H](C)OC1=C(C=C(C=C1)C=C2C(=O)C3=CC=CC=C3C2=O)Cl

InChI

InChI=1S/C20H17ClO3/c1-3-12(2)24-18-9-8-13(11-17(18)21)10-16-19(22)14-6-4-5-7-15(14)20(16)23/h4-12H,3H2,1-2H3/t12-/m0/s1