3-(2-chloranyl-6-nitro-phenyl)-N-[4-(diethylamino)phenyl]-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chloranyl-6-nitro-phenyl)-N-[4-(diethylamino)phenyl]-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chloro-6-nitro-phenyl)-N-[4-(diethylamino)phenyl]-5-methyl-isoxazole-4-carboxamide CAS Name: 3-(2-chloro-6-nitrophenyl)-N-[4-(diethylamino)phenyl]-5-methyl-4-isoxazolecarboxamide IUPAC Name: 3-(2-chloro-6-nitrophenyl)-N-[4-(diethylamino)phenyl]-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chloro-6-nitro-phenyl)-N-[4-(diethylamino)phenyl]-5-methyl-isoxazole-4-carboxamide Formula: C21H21ClN4O4 MolecularWeight: 428.86884

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)C2=C(ON=C2C3=C(C=CC=C3Cl)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)C2=C(ON=C2C3=C(C=CC=C3Cl)[N+](=O)[O-])C

InChI

InChI=1S/C21H21ClN4O4/c1-4-25(5-2)15-11-9-14(10-12-15)23-21(27)18-13(3)30-24-20(18)19-16(22)7-6-8-17(19)26(28)29/h6-12H,4-5H2,1-3H3,(H,23,27)