3-[2-(dimethylamino)-2-methyl-propanoyl]benzo[b][1]benzothiepine-5,6-dione

Systemtic Name: 3-[2-(dimethylamino)-2-methyl-propanoyl]benzo[b][1]benzothiepine-5,6-dione Openeye Name: 3-[2-(dimethylamino)-2-methyl-propanoyl]benzo[b][1]benzothiepine-5,6-dione CAS Name: 3-[2-(dimethylamino)-2-methyl-1-oxopropyl]benzo[b][1]benzothiepin-5,6-dione IUPAC Name: 3-[2-(dimethylamino)-2-methylpropanoyl]benzo[b][1]benzothiepine-5,6-dione Traditional Name: 3-[2-(dimethylamino)-2-methyl-propanoyl]benzo[b][1]benzothiepin-5,6-quinone Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2=O)N(C)C

Isomeric SMILES

CC(C)(C(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)C2=O)N(C)C

InChI

InChI=1S/C20H19NO3S/c1-20(2,21(3)4)19(24)12-9-10-16-14(11-12)18(23)17(22)13-7-5-6-8-15(13)25-16/h5-11H,1-4H3