7-chloranyl-N,N-diethyl-5-methyl-3-(3-nitrophenyl)-4-oxidanylidene-pyridazino[4,5-b]indole-1-carboxamide

Systemtic Name: 7-chloranyl-N,N-diethyl-5-methyl-3-(3-nitrophenyl)-4-oxidanylidene-pyridazino[4,5-b]indole-1-carboxamide Openeye Name: 7-chloro-N,N-diethyl-5-methyl-3-(3-nitrophenyl)-4-oxo-pyridazino[4,5-b]indole-1-carboxamide CAS Name: 7-chloro-N,N-diethyl-5-methyl-3-(3-nitrophenyl)-4-oxo-1-pyridazino[4,5-b]indolecarboxamide IUPAC Name: 7-chloro-N,N-diethyl-5-methyl-3-(3-nitrophenyl)-4-oxopyridazino[4,5-b]indole-1-carboxamide Traditional Name: 7-chloro-N,N-diethyl-4-keto-5-methyl-3-(3-nitrophenyl)pyridazin[4,5-b]indole-1-carboxamide Formula: C22H20ClN5O4 MolecularWeight: 453.8783

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=NN(C(=O)C2=C1C3=C(N2C)C=C(C=C3)Cl)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)C1=NN(C(=O)C2=C1C3=C(N2C)C=C(C=C3)Cl)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN5O4/c1-4-26(5-2)21(29)19-18-16-10-9-13(23)11-17(16)25(3)20(18)22(30)27(24-19)14-7-6-8-15(12-14)28(31)32/h6-12H,4-5H2,1-3H3