4-[(4-methyl-1,3-benzothiazol-2-yl)amino]-3-nitro-chromen-2-one

Systemtic Name: 4-[(4-methyl-1,3-benzothiazol-2-yl)amino]-3-nitro-chromen-2-one Openeye Name: 4-[(4-methyl-1,3-benzothiazol-2-yl)amino]-3-nitro-chromen-2-one CAS Name: 4-[(4-methyl-1,3-benzothiazol-2-yl)amino]-3-nitro-1-benzopyran-2-one IUPAC Name: 4-[(4-methyl-1,3-benzothiazol-2-yl)amino]-3-nitrochromen-2-one Traditional Name: 4-[(4-methyl-1,3-benzothiazol-2-yl)amino]-3-nitro-coumarin Formula: C17H11N3O4S MolecularWeight: 353.35194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=O)OC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=O)OC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O4S/c1-9-5-4-8-12-13(9)18-17(25-12)19-14-10-6-2-3-7-11(10)24-16(21)15(14)20(22)23/h2-8H,1H3,(H,18,19)