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

Systemtic Name: 4-chloranyl-N-ethyl-N-[1-[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-ethyl-N-[1-[3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-ethyl-N-[1-[3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]propyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-ethyl-N-[1-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]propyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-ethyl-N-[1-[4-keto-3-(4-methoxyphenyl)quinazolin-2-yl]propyl]-3-nitro-benzamide Formula: C27H25ClN4O5 MolecularWeight: 520.9642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25ClN4O5/c1-4-23(30(5-2)26(33)17-10-15-21(28)24(16-17)32(35)36)25-29-22-9-7-6-8-20(22)27(34)31(25)18-11-13-19(37-3)14-12-18/h6-16,23H,4-5H2,1-3H3