3-(4-dodecylphenyl)carbonyl-1,1-bis(oxidanylidene)-2,3-dihydro-1$l^{6},2-benzothiazin-4-one

Systemtic Name: 3-(4-dodecylphenyl)carbonyl-1,1-bis(oxidanylidene)-2,3-dihydro-1$l^{6},2-benzothiazin-4-one Openeye Name: 3-(4-dodecylbenzoyl)-1,1-dioxo-2,3-dihydro-1$l^{6},2-benzothiazin-4-one CAS Name: 3-[(4-dodecylphenyl)-oxomethyl]-1,1-dioxo-2,3-dihydro-1$l^{6},2-benzothiazin-4-one IUPAC Name: 3-(4-dodecylbenzoyl)-1,1-dioxo-2,3-dihydro-1$l^{6},2-benzothiazin-4-one Traditional Name: 1,1-diketo-3-(4-laurylbenzoyl)-2,3-dihydro-1$l^{6},2-benzothiazin-4-one Formula: C27H35NO4S MolecularWeight: 469.6361

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C2C(=O)C3=CC=CC=C3S(=O)(=O)N2

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C(=O)C2C(=O)C3=CC=CC=C3S(=O)(=O)N2

InChI

InChI=1S/C27H35NO4S/c1-2-3-4-5-6-7-8-9-10-11-14-21-17-19-22(20-18-21)26(29)25-27(30)23-15-12-13-16-24(23)33(31,32)28-25/h12-13,15-20,25,28H,2-11,14H2,1H3