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

Systemtic Name: N-[(E)-[5-chloranyl-2-oxidanylidene-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]-3,5-dinitro-benzamide Openeye Name: N-[(E)-[5-chloro-2-oxo-1-(1-piperidylmethyl)indolin-3-ylidene]amino]-3,5-dinitro-benzamide CAS Name: N-[(E)-[5-chloro-2-oxo-1-(1-piperidinylmethyl)-3-indolylidene]amino]-3,5-dinitrobenzamide IUPAC Name: N-[(E)-[5-chloro-2-oxo-1-(piperidin-1-ylmethyl)indol-3-ylidene]amino]-3,5-dinitrobenzamide Traditional Name: N-[(E)-[5-chloro-2-keto-1-(piperidinomethyl)indolin-3-ylidene]amino]-3,5-dinitro-benzamide Formula: C21H19ClN6O6 MolecularWeight: 486.86516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CN2C3=C(C=C(C=C3)Cl)C(=NNC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])C2=O

Isomeric SMILES

C1CCN(CC1)CN2C3=C(C=C(C=C3)Cl)/C(=N\NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-])/C2=O

InChI

InChI=1S/C21H19ClN6O6/c22-14-4-5-18-17(10-14)19(21(30)26(18)12-25-6-2-1-3-7-25)23-24-20(29)13-8-15(27(31)32)11-16(9-13)28(33)34/h4-5,8-11H,1-3,6-7,12H2,(H,24,29)/b23-19+