4-chloranyl-N-[2-(diethylamino)-4-methyl-quinolin-6-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[2-(diethylamino)-4-methyl-quinolin-6-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-(diethylamino)-4-methyl-6-quinolyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-(diethylamino)-4-methyl-6-quinolinyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-(diethylamino)-4-methylquinolin-6-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-(diethylamino)-4-methyl-6-quinolyl]-3-nitro-benzamide Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=C1)C

Isomeric SMILES

CCN(CC)C1=NC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=C1)C

InChI

InChI=1S/C21H21ClN4O3/c1-4-25(5-2)20-10-13(3)16-12-15(7-9-18(16)24-20)23-21(27)14-6-8-17(22)19(11-14)26(28)29/h6-12H,4-5H2,1-3H3,(H,23,27)