6-chloranyl-4-cyclopropyl-4-[2-(2-nitrophenyl)ethynyl]-1,3-dihydroquinazolin-2-one

Systemtic Name: 6-chloranyl-4-cyclopropyl-4-[2-(2-nitrophenyl)ethynyl]-1,3-dihydroquinazolin-2-one Openeye Name: 6-chloro-4-cyclopropyl-4-[2-(2-nitrophenyl)ethynyl]-1,3-dihydroquinazolin-2-one CAS Name: 6-chloro-4-cyclopropyl-4-[2-(2-nitrophenyl)ethynyl]-1,3-dihydroquinazolin-2-one IUPAC Name: 6-chloro-4-cyclopropyl-4-[2-(2-nitrophenyl)ethynyl]-1,3-dihydroquinazolin-2-one Traditional Name: 6-chloro-4-cyclopropyl-4-[2-(2-nitrophenyl)ethynyl]-1,3-dihydroquinazolin-2-one Formula: C19H14ClN3O3 MolecularWeight: 367.78576

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2(C3=C(C=CC(=C3)Cl)NC(=O)N2)C#CC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CC1C2(C3=C(C=CC(=C3)Cl)NC(=O)N2)C#CC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C19H14ClN3O3/c20-14-7-8-16-15(11-14)19(13-5-6-13,22-18(24)21-16)10-9-12-3-1-2-4-17(12)23(25)26/h1-4,7-8,11,13H,5-6H2,(H2,21,22,24)