N-[[5-methyl-1-(3-methylbutyl)-2-oxidanylidene-indol-3-ylidene]amino]-3,5-dinitro-benzamide

Systemtic Name: N-[[5-methyl-1-(3-methylbutyl)-2-oxidanylidene-indol-3-ylidene]amino]-3,5-dinitro-benzamide Openeye Name: N-[(1-isopentyl-5-methyl-2-oxo-indolin-3-ylidene)amino]-3,5-dinitro-benzamide CAS Name: N-[[5-methyl-1-(3-methylbutyl)-2-oxo-3-indolylidene]amino]-3,5-dinitrobenzamide IUPAC Name: N-[[5-methyl-1-(3-methylbutyl)-2-oxoindol-3-ylidene]amino]-3,5-dinitrobenzamide Traditional Name: N-[(1-isoamyl-2-keto-5-methyl-indolin-3-ylidene)amino]-3,5-dinitro-benzamide Formula: C21H21N5O6 MolecularWeight: 439.42134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=NNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])CCC(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2=NNC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])CCC(C)C

InChI

InChI=1S/C21H21N5O6/c1-12(2)6-7-24-18-5-4-13(3)8-17(18)19(21(24)28)22-23-20(27)14-9-15(25(29)30)11-16(10-14)26(31)32/h4-5,8-12H,6-7H2,1-3H3,(H,23,27)