6-ethyl-5-phenyl-2-prop-2-enoxy-benzo[b][1]benzothiepine

Systemtic Name: 6-ethyl-5-phenyl-2-prop-2-enoxy-benzo[b][1]benzothiepine Openeye Name: 2-allyloxy-6-ethyl-5-phenyl-benzo[b][1]benzothiepine CAS Name: 6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzothiepin IUPAC Name: 6-ethyl-5-phenyl-2-prop-2-enoxybenzo[b][1]benzothiepine Traditional Name: 2-allyloxy-6-ethyl-5-phenyl-benzo[b][1]benzothiepin Formula: C25H22OS MolecularWeight: 370.50658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=C(C=C2)OCC=C)SC3=CC=CC=C31)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(C2=C(C=C(C=C2)OCC=C)SC3=CC=CC=C31)C4=CC=CC=C4

InChI

InChI=1S/C25H22OS/c1-3-16-26-19-14-15-22-24(17-19)27-23-13-9-8-12-21(23)20(4-2)25(22)18-10-6-5-7-11-18/h3,5-15,17H,1,4,16H2,2H3