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

Systemtic Name: N-(6-azanylhexyl)-N-[1-(7-chloranyl-3-methyl-4-oxidanylidene-quinazolin-2-yl)ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-(6-aminohexyl)-N-[1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-(6-aminohexyl)-N-[1-(7-chloro-3-methyl-4-oxo-2-quinazolinyl)ethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-(6-aminohexyl)-N-[1-(7-chloro-3-methyl-4-oxoquinazolin-2-yl)ethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-(6-aminohexyl)-N-[1-(7-chloro-4-keto-3-methyl-quinazolin-2-yl)ethyl]-4-methyl-3-nitro-benzamide Formula: C25H30ClN5O4 MolecularWeight: 499.9898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CCCCCCN)C(C)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CCCCCCN)C(C)C2=NC3=C(C=CC(=C3)Cl)C(=O)N2C)[N+](=O)[O-]

InChI

InChI=1S/C25H30ClN5O4/c1-16-8-9-18(14-22(16)31(34)35)24(32)30(13-7-5-4-6-12-27)17(2)23-28-21-15-19(26)10-11-20(21)25(33)29(23)3/h8-11,14-15,17H,4-7,12-13,27H2,1-3H3