N-(2-methoxyethyl)-4-[(4-nitrophenyl)amino]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]butanamide

Systemtic Name: N-(2-methoxyethyl)-4-[(4-nitrophenyl)amino]-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]butanamide Openeye Name: N-(2-methoxyethyl)-4-(4-nitroanilino)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]butanamide CAS Name: N-(2-methoxyethyl)-4-(4-nitroanilino)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]butanamide IUPAC Name: N-(2-methoxyethyl)-4-(4-nitroanilino)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]butanamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(2-methoxyethyl)-4-(4-nitroanilino)butyramide Formula: C22H25N5O5 MolecularWeight: 439.4644

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O5/c1-32-14-13-26(15-20-24-19-6-3-2-5-18(19)22(29)25-20)21(28)7-4-12-23-16-8-10-17(11-9-16)27(30)31/h2-3,5-6,8-11,23H,4,7,12-15H2,1H3,(H,24,25,29)