4-(1,3-benzothiazol-2-yl)-4-propoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-4-propoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-(1,3-benzothiazol-2-yl)-4-propoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-(1,3-benzothiazol-2-yl)-4-propoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-(1,3-benzothiazol-2-yl)-4-propoxycyclohexa-2,5-dien-1-one Traditional Name: 4-(1,3-benzothiazol-2-yl)-4-propoxy-cyclohexa-2,5-dien-1-one Formula: C16H15NO2S MolecularWeight: 285.3608

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1(C=CC(=O)C=C1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCOC1(C=CC(=O)C=C1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H15NO2S/c1-2-11-19-16(9-7-12(18)8-10-16)15-17-13-5-3-4-6-14(13)20-15/h3-10H,2,11H2,1H3