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

Systemtic Name: N-butyl-2-chloranyl-N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-4-nitro-benzamide Openeye Name: N-butyl-2-chloro-N-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-4-nitro-benzamide CAS Name: N-butyl-2-chloro-N-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-4-nitrobenzamide IUPAC Name: N-butyl-2-chloro-N-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-4-nitrobenzamide Traditional Name: N-butyl-2-chloro-N-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)ethyl]-4-nitro-benzamide Formula: C29H29ClN4O5 MolecularWeight: 549.01736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H29ClN4O5/c1-4-6-17-32(28(35)23-16-13-21(34(37)38)18-25(23)30)19(3)27-31-26-10-8-7-9-24(26)29(36)33(27)20-11-14-22(15-12-20)39-5-2/h7-16,18-19H,4-6,17H2,1-3H3