methyl (2E,4E)-2-(4-butan-2-ylphenyl)sulfinyloxy-5-(dimethylamino)penta-2,4-dienoate

Systemtic Name: methyl (2E,4E)-2-(4-butan-2-ylphenyl)sulfinyloxy-5-(dimethylamino)penta-2,4-dienoate Openeye Name: methyl (2E,4E)-5-(dimethylamino)-2-(4-sec-butylphenyl)sulfinyloxy-penta-2,4-dienoate CAS Name: (2E,4E)-2-(4-butan-2-ylphenyl)sulfinyloxy-5-(dimethylamino)penta-2,4-dienoic acid methyl ester IUPAC Name: methyl (2E,4E)-2-(4-butan-2-ylphenyl)sulfinyloxy-5-(dimethylamino)penta-2,4-dienoate Traditional Name: (2E,4E)-5-(dimethylamino)-2-(4-sec-butylphenyl)sulfinyloxy-penta-2,4-dienoic acid methyl ester Formula: C18H25NO4S MolecularWeight: 351.4604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)OC(=CC=CN(C)C)C(=O)OC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)S(=O)O/C(=C/C=C/N(C)C)/C(=O)OC

InChI

InChI=1S/C18H25NO4S/c1-6-14(2)15-9-11-16(12-10-15)24(21)23-17(18(20)22-5)8-7-13-19(3)4/h7-14H,6H2,1-5H3/b13-7+,17-8+