(phenylmethyl) 3-(1H-indol-3-yl)-2-(4-oxidanylidenequinazolin-3-yl)propanoate

Systemtic Name: (phenylmethyl) 3-(1H-indol-3-yl)-2-(4-oxidanylidenequinazolin-3-yl)propanoate Openeye Name: benzyl 3-(1H-indol-3-yl)-2-(4-oxoquinazolin-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)-2-(4-oxo-3-quinazolinyl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(1H-indol-3-yl)-2-(4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)-2-(4-ketoquinazolin-3-yl)propionic acid benzyl ester Formula: C26H21N3O3 MolecularWeight: 423.46324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)N4C=NC5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)N4C=NC5=CC=CC=C5C4=O

InChI

InChI=1S/C26H21N3O3/c30-25-21-11-5-7-13-23(21)28-17-29(25)24(26(31)32-16-18-8-2-1-3-9-18)14-19-15-27-22-12-6-4-10-20(19)22/h1-13,15,17,24,27H,14,16H2