[3-[(E)-4-(7-heptoxy-4,4-dimethyl-2,3-dihydrothiochromen-6-yl)but-2-enyl]phenyl]-diphenyl-phosphane

Systemtic Name: [3-[(E)-4-(7-heptoxy-4,4-dimethyl-2,3-dihydrothiochromen-6-yl)but-2-enyl]phenyl]-diphenyl-phosphane Openeye Name: [3-[(E)-4-(7-heptoxy-4,4-dimethyl-thiochroman-6-yl)but-2-enyl]phenyl]-diphenyl-phosphane CAS Name: [3-[(E)-4-(7-heptoxy-4,4-dimethyl-2,3-dihydro-1-benzothiopyran-6-yl)but-2-enyl]phenyl]-diphenylphosphine IUPAC Name: [3-[(E)-4-(7-heptoxy-4,4-dimethyl-2,3-dihydrothiochromen-6-yl)but-2-enyl]phenyl]-diphenylphosphane Traditional Name: [3-[(E)-4-(7-heptoxy-4,4-dimethyl-thiochroman-6-yl)but-2-enyl]phenyl]-diphenyl-phosphine Formula: C40H47OPS MolecularWeight: 606.839341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C2C(=C1)SCCC2(C)C)CC=CCC3=CC(=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCCCCOC1=C(C=C2C(=C1)SCCC2(C)C)C/C=C/CC3=CC(=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C40H47OPS/c1-4-5-6-7-16-27-41-38-31-39-37(40(2,3)26-28-43-39)30-33(38)20-15-14-18-32-19-17-25-36(29-32)42(34-21-10-8-11-22-34)35-23-12-9-13-24-35/h8-15,17,19,21-25,29-31H,4-7,16,18,20,26-28H2,1-3H3/b15-14+