N-[(E)-[1-(morpholin-4-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]-3,5-dinitro-benzamide

Systemtic Name: N-[(E)-[1-(morpholin-4-ylmethyl)-2-oxidanylidene-indol-3-ylidene]amino]-3,5-dinitro-benzamide Openeye Name: N-[(E)-[1-(morpholinomethyl)-2-oxo-indolin-3-ylidene]amino]-3,5-dinitro-benzamide CAS Name: N-[(E)-[1-(4-morpholinylmethyl)-2-oxo-3-indolylidene]amino]-3,5-dinitrobenzamide IUPAC Name: N-[(E)-[1-(morpholin-4-ylmethyl)-2-oxoindol-3-ylidene]amino]-3,5-dinitrobenzamide Traditional Name: N-[(E)-[2-keto-1-(morpholinomethyl)indolin-3-ylidene]amino]-3,5-dinitro-benzamide Formula: C20H18N6O7 MolecularWeight: 454.39292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CN2C3=CC=CC=C3C(=NNC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])C2=O

Isomeric SMILES

C1COCCN1CN2C3=CC=CC=C3/C(=N\NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])/C2=O

InChI

InChI=1S/C20H18N6O7/c27-19(13-9-14(25(29)30)11-15(10-13)26(31)32)22-21-18-16-3-1-2-4-17(16)24(20(18)28)12-23-5-7-33-8-6-23/h1-4,9-11H,5-8,12H2,(H,22,27)/b21-18+