ethyl (4Z)-4-(3-azanyl-4-phenyl-2H-1,2-oxazol-5-ylidene)pyrrole-2-carboxylate

Systemtic Name: ethyl (4Z)-4-(3-azanyl-4-phenyl-2H-1,2-oxazol-5-ylidene)pyrrole-2-carboxylate Openeye Name: ethyl (4Z)-4-(3-amino-4-phenyl-2H-isoxazol-5-ylidene)pyrrole-2-carboxylate CAS Name: (4Z)-4-(3-amino-4-phenyl-2H-isoxazol-5-ylidene)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (4Z)-4-(3-amino-4-phenyl-2H-1,2-oxazol-5-ylidene)pyrrole-2-carboxylate Traditional Name: (4Z)-4-(3-amino-4-phenyl-3-isoxazolin-5-ylidene)pyrrole-2-carboxylic acid ethyl ester Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2C(=C(NO2)N)C3=CC=CC=C3)C=N1

Isomeric SMILES

CCOC(=O)C1=C/C(=C/2\C(=C(NO2)N)C3=CC=CC=C3)/C=N1

InChI

InChI=1S/C16H15N3O3/c1-2-21-16(20)12-8-11(9-18-12)14-13(15(17)19-22-14)10-6-4-3-5-7-10/h3-9,19H,2,17H2,1H3/b14-11-