(3Z)-3-(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid

Systemtic Name: (3Z)-3-(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid Openeye Name: (3Z)-3-(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid CAS Name: (3Z)-3-(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid IUPAC Name: (3Z)-3-(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid Traditional Name: (3Z)-3-(2-methyl-6H-benzo[c][1]benzothiepin-11-ylidene)propionic acid Formula: C18H16O2S MolecularWeight: 296.38344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SCC3=CC=CC=C3C2=CCC(=O)O

Isomeric SMILES

CC1=CC\2=C(C=C1)SCC3=CC=CC=C3/C2=C/CC(=O)O

InChI

InChI=1S/C18H16O2S/c1-12-6-8-17-16(10-12)15(7-9-18(19)20)14-5-3-2-4-13(14)11-21-17/h2-8,10H,9,11H2,1H3,(H,19,20)/b15-7-