N-[(1R)-1-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-nitro-benzamide

Systemtic Name: N-[(1R)-1-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3-nitro-benzamide Openeye Name: N-[(1R)-1-[3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]ethyl]-3-nitro-benzamide CAS Name: N-[(1R)-1-[3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]ethyl]-3-nitrobenzamide IUPAC Name: N-[(1R)-1-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]ethyl]-3-nitrobenzamide Traditional Name: N-[(1R)-1-[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]ethyl]-3-nitro-benzamide Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=O)N1CCOC)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2C(=O)N1CCOC)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O5/c1-13(21-19(25)14-6-5-7-15(12-14)24(27)28)18-22-17-9-4-3-8-16(17)20(26)23(18)10-11-29-2/h3-9,12-13H,10-11H2,1-2H3,(H,21,25)/t13-/m1/s1