N-(6-azanylhexyl)-2-chloranyl-N-[1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-4-nitro-benzamide

Systemtic Name: N-(6-azanylhexyl)-2-chloranyl-N-[1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-4-nitro-benzamide Openeye Name: N-(6-aminohexyl)-2-chloro-N-[1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]-4-nitro-benzamide CAS Name: N-(6-aminohexyl)-2-chloro-N-[1-(7-chloro-3-methyl-4-oxo-2-quinazolinyl)ethyl]-4-nitrobenzamide IUPAC Name: N-(6-aminohexyl)-2-chloro-N-[1-(7-chloro-3-methyl-4-oxoquinazolin-2-yl)ethyl]-4-nitrobenzamide Traditional Name: N-(6-aminohexyl)-2-chloro-N-[1-(7-chloro-4-keto-3-methyl-quinazolin-2-yl)ethyl]-4-nitro-benzamide Formula: C24H27Cl2N5O4 MolecularWeight: 520.40828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C)N(CCCCCCN)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C1=NC2=C(C=CC(=C2)Cl)C(=O)N1C)N(CCCCCCN)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C24H27Cl2N5O4/c1-15(22-28-21-13-16(25)7-9-19(21)23(32)29(22)2)30(12-6-4-3-5-11-27)24(33)18-10-8-17(31(34)35)14-20(18)26/h7-10,13-15H,3-6,11-12,27H2,1-2H3