ethyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-[(Z)-3-(4-nitrophenyl)prop-2-enoyl]imino-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-[(Z)-3-(4-nitrophenyl)prop-2-enoyl]imino-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-(2-ethoxy-2-oxo-ethyl)-2-[(Z)-3-(4-nitrophenyl)prop-2-enoyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxy-2-oxoethyl)-2-[(Z)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-ethoxy-2-oxoethyl)-2-[(Z)-3-(4-nitrophenyl)prop-2-enoyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxy-2-keto-ethyl)-2-[(Z)-3-(4-nitrophenyl)acryloyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C23H21N3O7S MolecularWeight: 483.49374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)/C=C\C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O7S/c1-3-32-21(28)14-25-18-11-8-16(22(29)33-4-2)13-19(18)34-23(25)24-20(27)12-7-15-5-9-17(10-6-15)26(30)31/h5-13H,3-4,14H2,1-2H3/b12-7-,24-23?