ethyl (3S)-3-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]-3-phenyl-propanoate

Systemtic Name: ethyl (3S)-3-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]-3-phenyl-propanoate Openeye Name: ethyl (3S)-3-[3-(4-oxoquinazolin-3-yl)propanoylamino]-3-phenyl-propanoate CAS Name: (3S)-3-[[1-oxo-3-(4-oxo-3-quinazolinyl)propyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (3S)-3-[3-(4-oxoquinazolin-3-yl)propanoylamino]-3-phenylpropanoate Traditional Name: (3S)-3-[3-(4-ketoquinazolin-3-yl)propanoylamino]-3-phenyl-propionic acid ethyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC=CC=C1)NC(=O)CCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C[C@@H](C1=CC=CC=C1)NC(=O)CCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C22H23N3O4/c1-2-29-21(27)14-19(16-8-4-3-5-9-16)24-20(26)12-13-25-15-23-18-11-7-6-10-17(18)22(25)28/h3-11,15,19H,2,12-14H2,1H3,(H,24,26)/t19-/m0/s1