[(1E,3S)-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hexa-1,5-dien-3-yl] oct-7-enoate

Systemtic Name: [(1E,3S)-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hexa-1,5-dien-3-yl] oct-7-enoate Openeye Name: [(1S)-1-[(E)-1-methyl-2-(2-methylthiazol-4-yl)vinyl]but-3-enyl] oct-7-enoate CAS Name: 7-octenoic acid [(1E,3S)-2-methyl-1-(2-methyl-4-thiazolyl)hexa-1,5-dien-3-yl] ester IUPAC Name: [(1E,3S)-2-methyl-1-(2-methyl-1,3-thiazol-4-yl)hexa-1,5-dien-3-yl] oct-7-enoate Traditional Name: oct-7-enoic acid [(1S)-1-[(E)-1-methyl-2-(2-methylthiazol-4-yl)vinyl]but-3-enyl] ester Formula: C19H27NO2S MolecularWeight: 333.48818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=C(C)C(CC=C)OC(=O)CCCCCC=C

Isomeric SMILES

CC1=NC(=CS1)/C=C(\C)/[C@H](CC=C)OC(=O)CCCCCC=C

InChI

InChI=1S/C19H27NO2S/c1-5-7-8-9-10-12-19(21)22-18(11-6-2)15(3)13-17-14-23-16(4)20-17/h5-6,13-14,18H,1-2,7-12H2,3-4H3/b15-13+/t18-/m0/s1