ethyl 2-[2-[(4-methoxyphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-4-yl]-4-methyl-pentanoate

Systemtic Name: ethyl 2-[2-[(4-methoxyphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-4-yl]-4-methyl-pentanoate Openeye Name: ethyl 2-[2-[(4-methoxyphenyl)methyl]-3-oxo-1,4-benzothiazin-4-yl]-4-methyl-pentanoate CAS Name: 2-[2-[(4-methoxyphenyl)methyl]-3-oxo-1,4-benzothiazin-4-yl]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-methoxyphenyl)methyl]-3-oxo-1,4-benzothiazin-4-yl]-4-methylpentanoate Traditional Name: 2-(3-keto-2-p-anisyl-1,4-benzothiazin-4-yl)-4-methyl-valeric acid ethyl ester Formula: C24H29NO4S MolecularWeight: 427.55636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)N1C2=CC=CC=C2SC(C1=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C(CC(C)C)N1C2=CC=CC=C2SC(C1=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C24H29NO4S/c1-5-29-24(27)20(14-16(2)3)25-19-8-6-7-9-21(19)30-22(23(25)26)15-17-10-12-18(28-4)13-11-17/h6-13,16,20,22H,5,14-15H2,1-4H3