N-butyl-2-chloranyl-N-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-4-nitro-benzamide

Systemtic Name: N-butyl-2-chloranyl-N-[1-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-4-nitro-benzamide Openeye Name: N-butyl-2-chloro-N-[1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-4-nitro-benzamide CAS Name: N-butyl-2-chloro-N-[1-[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]propyl]-4-nitrobenzamide IUPAC Name: N-butyl-2-chloro-N-[1-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]propyl]-4-nitrobenzamide Traditional Name: N-butyl-2-chloro-N-[1-[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]propyl]-4-nitro-benzamide Formula: C30H31ClN4O4 MolecularWeight: 547.04454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)CC)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCN(C(CC)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)CC)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C30H31ClN4O4/c1-4-7-18-33(29(36)23-17-16-22(35(38)39)19-25(23)31)27(6-3)28-32-26-11-9-8-10-24(26)30(37)34(28)21-14-12-20(5-2)13-15-21/h8-17,19,27H,4-7,18H2,1-3H3