methyl 2-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(3-nitrophenyl)methyleneamino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(3-nitrobenzylidene)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C16H11N3O4S MolecularWeight: 341.34124

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(S2)N=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(S2)N=CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O4S/c1-23-15(20)11-5-6-13-14(8-11)24-16(18-13)17-9-10-3-2-4-12(7-10)19(21)22/h2-9H,1H3