N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-3-nitro-benzamide

Systemtic Name: N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-3-nitro-benzamide Openeye Name: N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-nitro-benzamide CAS Name: N-[(E)-[2-[(tert-butylhydrazo)-oxomethyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-nitrobenzamide IUPAC Name: N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-3-nitrobenzamide Traditional Name: N-[(E)-[2-[(tert-butylamino)carbamoyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-nitro-benzamide Formula: C21H25N5O5 MolecularWeight: 427.4537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])CCC2)C(=O)NNC(C)(C)C

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])/CCC2)C(=O)NNC(C)(C)C

InChI

InChI=1S/C21H25N5O5/c1-12-17-15(22-23-19(27)13-7-5-8-14(11-13)26(29)30)9-6-10-16(17)31-18(12)20(28)24-25-21(2,3)4/h5,7-8,11,25H,6,9-10H2,1-4H3,(H,23,27)(H,24,28)/b22-15+