azepan-1-yl-[6,7-dimethoxy-4-methyl-2,2-bis(oxidanylidene)-1-prop-2-enyl-2$l^{6},1-benzothiazin-3-yl]methanone

Systemtic Name: azepan-1-yl-[6,7-dimethoxy-4-methyl-2,2-bis(oxidanylidene)-1-prop-2-enyl-2$l^{6},1-benzothiazin-3-yl]methanone Openeye Name: (1-allyl-6,7-dimethoxy-4-methyl-2,2-dioxo-2$l^{6},1-benzothiazin-3-yl)-(azepan-1-yl)methanone CAS Name: 1-azepanyl-(6,7-dimethoxy-4-methyl-2,2-dioxo-1-prop-2-enyl-2$l^{6},1-benzothiazin-3-yl)methanone IUPAC Name: azepan-1-yl-(6,7-dimethoxy-4-methyl-2,2-dioxo-1-prop-2-enyl-2$l^{6},1-benzothiazin-3-yl)methanone Traditional Name: (1-allyl-2,2-diketo-6,7-dimethoxy-4-methyl-2$l^{6},1-benzothiazin-3-yl)-(azepan-1-yl)methanone Formula: C21H28N2O5S MolecularWeight: 420.52242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(S(=O)(=O)N(C2=CC(=C(C=C12)OC)OC)CC=C)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(S(=O)(=O)N(C2=CC(=C(C=C12)OC)OC)CC=C)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H28N2O5S/c1-5-10-23-17-14-19(28-4)18(27-3)13-16(17)15(2)20(29(23,25)26)21(24)22-11-8-6-7-9-12-22/h5,13-14H,1,6-12H2,2-4H3