N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-2-[(4-methoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-2-[(4-methoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-2-[(4-methoxyphenyl)methylene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-piperidin-1-iumyl)propyl]-2-[(4-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-2-[(4-methoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-[3-(3,5-dimethylpiperidin-1-ium-1-yl)propyl]-3-keto-2-p-anisylidene-4H-1,4-benzothiazine-6-carboxamide Formula: C27H34N3O3S+ MolecularWeight: 480.64216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC=C(C=C4)OC)C(=O)N3)C

Isomeric SMILES

CC1CC(C[NH+](C1)CCCNC(=O)C2=CC3=C(C=C2)SC(=CC4=CC=C(C=C4)OC)C(=O)N3)C

InChI

InChI=1S/C27H33N3O3S/c1-18-13-19(2)17-30(16-18)12-4-11-28-26(31)21-7-10-24-23(15-21)29-27(32)25(34-24)14-20-5-8-22(33-3)9-6-20/h5-10,14-15,18-19H,4,11-13,16-17H2,1-3H3,(H,28,31)(H,29,32)/p+1