3-[3-[(4-chloranyl-2-nitro-phenyl)amino]propyl]quinazolin-4-one

Systemtic Name: 3-[3-[(4-chloranyl-2-nitro-phenyl)amino]propyl]quinazolin-4-one Openeye Name: 3-[3-(4-chloro-2-nitro-anilino)propyl]quinazolin-4-one CAS Name: 3-[3-(4-chloro-2-nitroanilino)propyl]-4-quinazolinone IUPAC Name: 3-[3-(4-chloro-2-nitroanilino)propyl]quinazolin-4-one Traditional Name: 3-[3-(4-chloro-2-nitro-anilino)propyl]quinazolin-4-one Formula: C17H15ClN4O3 MolecularWeight: 358.779

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCNC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCNC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClN4O3/c18-12-6-7-15(16(10-12)22(24)25)19-8-3-9-21-11-20-14-5-2-1-4-13(14)17(21)23/h1-2,4-7,10-11,19H,3,8-9H2