3-[4,5,6,6-tetramethoxy-5-propoxy-2-(thiolan-2-yl)cyclohexa-1,3-dien-1-yl]aniline

Systemtic Name: 3-[4,5,6,6-tetramethoxy-5-propoxy-2-(thiolan-2-yl)cyclohexa-1,3-dien-1-yl]aniline Openeye Name: 3-(4,5,6,6-tetramethoxy-5-propoxy-2-tetrahydrothiophen-2-yl-cyclohexa-1,3-dien-1-yl)aniline CAS Name: 3-[4,5,6,6-tetramethoxy-5-propoxy-2-(2-thiolanyl)-1-cyclohexa-1,3-dienyl]aniline IUPAC Name: 3-[4,5,6,6-tetramethoxy-5-propoxy-2-(thiolan-2-yl)cyclohexa-1,3-dien-1-yl]aniline Traditional Name: [3-(4,5,6,6-tetramethoxy-5-propoxy-2-tetrahydrothiophen-2-yl-cyclohexa-1,3-dien-1-yl)phenyl]amine Formula: C23H33NO5S MolecularWeight: 435.57682

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1(C(=CC(=C(C1(OC)OC)C2=CC(=CC=C2)N)C3CCCS3)OC)OC

Isomeric SMILES

CCCOC1(C(=CC(=C(C1(OC)OC)C2=CC(=CC=C2)N)C3CCCS3)OC)OC

InChI

InChI=1S/C23H33NO5S/c1-6-12-29-22(26-3)20(25-2)15-18(19-11-8-13-30-19)21(23(22,27-4)28-5)16-9-7-10-17(24)14-16/h7,9-10,14-15,19H,6,8,11-13,24H2,1-5H3