(3S)-3-[(6-nitro-4-phenyl-quinazolin-2-yl)amino]-3-phenyl-propanoate

Systemtic Name: (3S)-3-[(6-nitro-4-phenyl-quinazolin-2-yl)amino]-3-phenyl-propanoate Openeye Name: (3S)-3-[(6-nitro-4-phenyl-quinazolin-2-yl)amino]-3-phenyl-propanoate CAS Name: (3S)-3-[(6-nitro-4-phenyl-2-quinazolinyl)amino]-3-phenylpropanoate IUPAC Name: (3S)-3-[(6-nitro-4-phenylquinazolin-2-yl)amino]-3-phenylpropanoate Traditional Name: (3S)-3-[(6-nitro-4-phenyl-quinazolin-2-yl)amino]-3-phenyl-propionate Formula: C23H17N4O4- MolecularWeight: 413.40548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)[N+](=O)[O-])NC(CC(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)[N+](=O)[O-])N[C@@H](CC(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H18N4O4/c28-21(29)14-20(15-7-3-1-4-8-15)25-23-24-19-12-11-17(27(30)31)13-18(19)22(26-23)16-9-5-2-6-10-16/h1-13,20H,14H2,(H,28,29)(H,24,25,26)/p-1/t20-/m0/s1