3-(1,1-dipropoxypropan-2-yl)-6H-benzo[c][1]benzothiepin-11-one

Systemtic Name: 3-(1,1-dipropoxypropan-2-yl)-6H-benzo[c][1]benzothiepin-11-one Openeye Name: 3-(1-methyl-2,2-dipropoxy-ethyl)-6H-benzo[c][1]benzothiepin-11-one CAS Name: 3-(1,1-dipropoxypropan-2-yl)-6H-benzo[c][1]benzothiepin-11-one IUPAC Name: 3-(1,1-dipropoxypropan-2-yl)-6H-benzo[c][1]benzothiepin-11-one Traditional Name: 3-(1-methyl-2,2-dipropoxy-ethyl)-6H-benzo[c][1]benzothiepin-11-one Formula: C23H28O3S MolecularWeight: 384.53162

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3CS2)OCCC

Isomeric SMILES

CCCOC(C(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3CS2)OCCC

InChI

InChI=1S/C23H28O3S/c1-4-12-25-23(26-13-5-2)16(3)17-10-11-20-21(14-17)27-15-18-8-6-7-9-19(18)22(20)24/h6-11,14,16,23H,4-5,12-13,15H2,1-3H3