N-[2-(4-tert-butylphenyl)-4-oxidanylidene-quinazolin-3-yl]-4-chloranyl-3-nitro-benzamide

Systemtic Name: N-[2-(4-tert-butylphenyl)-4-oxidanylidene-quinazolin-3-yl]-4-chloranyl-3-nitro-benzamide Openeye Name: N-[2-(4-tert-butylphenyl)-4-oxo-quinazolin-3-yl]-4-chloro-3-nitro-benzamide CAS Name: N-[2-(4-tert-butylphenyl)-4-oxo-3-quinazolinyl]-4-chloro-3-nitrobenzamide IUPAC Name: N-[2-(4-tert-butylphenyl)-4-oxoquinazolin-3-yl]-4-chloro-3-nitrobenzamide Traditional Name: N-[2-(4-tert-butylphenyl)-4-keto-quinazolin-3-yl]-4-chloro-3-nitro-benzamide Formula: C25H21ClN4O4 MolecularWeight: 476.91164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H21ClN4O4/c1-25(2,3)17-11-8-15(9-12-17)22-27-20-7-5-4-6-18(20)24(32)29(22)28-23(31)16-10-13-19(26)21(14-16)30(33)34/h4-14H,1-3H3,(H,28,31)