2-chloranyl-1-ethoxy-4-[3-methyl-6-(3-phenoxyphenyl)hexan-3-yl]benzene

Systemtic Name: 2-chloranyl-1-ethoxy-4-[3-methyl-6-(3-phenoxyphenyl)hexan-3-yl]benzene Openeye Name: 2-chloro-1-ethoxy-4-[1-ethyl-1-methyl-4-(3-phenoxyphenyl)butyl]benzene CAS Name: 2-chloro-1-ethoxy-4-[3-methyl-6-(3-phenoxyphenyl)hexan-3-yl]benzene IUPAC Name: 2-chloro-1-ethoxy-4-[3-methyl-6-(3-phenoxyphenyl)hexan-3-yl]benzene Traditional Name: 2-chloro-1-ethoxy-4-[1-ethyl-1-methyl-4-(3-phenoxyphenyl)butyl]benzene Formula: C27H31ClO2 MolecularWeight: 422.98684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)C3=CC(=C(C=C3)OCC)Cl

Isomeric SMILES

CCC(C)(CCCC1=CC(=CC=C1)OC2=CC=CC=C2)C3=CC(=C(C=C3)OCC)Cl

InChI

InChI=1S/C27H31ClO2/c1-4-27(3,22-16-17-26(29-5-2)25(28)20-22)18-10-12-21-11-9-15-24(19-21)30-23-13-7-6-8-14-23/h6-9,11,13-17,19-20H,4-5,10,12,18H2,1-3H3