N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-5-(3-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[3-methoxy-4-[(2-methyl-1-oxopropyl)amino]phenyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[4-(isobutyrylamino)-3-methoxy-phenyl]-5-(3-nitrophenyl)-2-furamide Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H21N3O6/c1-13(2)21(26)24-17-8-7-15(12-20(17)30-3)23-22(27)19-10-9-18(31-19)14-5-4-6-16(11-14)25(28)29/h4-13H,1-3H3,(H,23,27)(H,24,26)