[1-[(Z)-4-methoxybut-2-enyl]-1H-isothiochromen-3-yl]-phenyl-methanone

Systemtic Name: [1-[(Z)-4-methoxybut-2-enyl]-1H-isothiochromen-3-yl]-phenyl-methanone Openeye Name: [1-[(Z)-4-methoxybut-2-enyl]-1H-isothiochromen-3-yl]-phenyl-methanone CAS Name: [1-[(Z)-4-methoxybut-2-enyl]-1H-2-benzothiopyran-3-yl]-phenylmethanone IUPAC Name: [1-[(Z)-4-methoxybut-2-enyl]-1H-isothiochromen-3-yl]-phenylmethanone Traditional Name: [1-[(Z)-4-methoxybut-2-enyl]-1H-isothiochromen-3-yl]-phenyl-methanone Formula: C21H20O2S MolecularWeight: 336.4473

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC=CCC1C2=CC=CC=C2C=C(S1)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC/C=C\CC1C2=CC=CC=C2C=C(S1)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20O2S/c1-23-14-8-7-13-19-18-12-6-5-11-17(18)15-20(24-19)21(22)16-9-3-2-4-10-16/h2-12,15,19H,13-14H2,1H3/b8-7-