N-[2-[(2-nitrophenyl)amino]ethyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[2-[(2-nitrophenyl)amino]ethyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[2-(2-nitroanilino)ethyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[2-(2-nitroanilino)ethyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[2-(2-nitroanilino)ethyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: 4-(4-ketoquinazolin-3-yl)-N-[2-(2-nitroanilino)ethyl]butyramide Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCC(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O4/c26-19(22-12-11-21-17-8-3-4-9-18(17)25(28)29)10-5-13-24-14-23-16-7-2-1-6-15(16)20(24)27/h1-4,6-9,14,21H,5,10-13H2,(H,22,26)