3-[2-(3-nitrophenyl)carbonylimino-4-phenyl-1,3-thiazol-3-yl]benzoic acid

Systemtic Name: 3-[2-(3-nitrophenyl)carbonylimino-4-phenyl-1,3-thiazol-3-yl]benzoic acid Openeye Name: 3-[2-(3-nitrobenzoyl)imino-4-phenyl-thiazol-3-yl]benzoic acid CAS Name: 3-[2-[(3-nitrophenyl)-oxomethyl]imino-4-phenyl-3-thiazolyl]benzoic acid IUPAC Name: 3-[2-(3-nitrobenzoyl)imino-4-phenyl-1,3-thiazol-3-yl]benzoic acid Traditional Name: 3-[2-(3-nitrobenzoyl)imino-4-phenyl-4-thiazolin-3-yl]benzoic acid Formula: C23H15N3O5S MolecularWeight: 445.4473

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N2C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])N2C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C23H15N3O5S/c27-21(16-8-4-11-19(12-16)26(30)31)24-23-25(18-10-5-9-17(13-18)22(28)29)20(14-32-23)15-6-2-1-3-7-15/h1-14H,(H,28,29)