methyl 5-(4-cyanophenyl)-3-[phenyl(quinazolin-7-yloxycarbonyl)amino]pentanoate

Systemtic Name: methyl 5-(4-cyanophenyl)-3-[phenyl(quinazolin-7-yloxycarbonyl)amino]pentanoate Openeye Name: methyl 5-(4-cyanophenyl)-3-(N-quinazolin-7-yloxycarbonylanilino)pentanoate CAS Name: 5-(4-cyanophenyl)-3-(N-[oxo(7-quinazolinyloxy)methyl]anilino)pentanoic acid methyl ester IUPAC Name: methyl 5-(4-cyanophenyl)-3-(N-quinazolin-7-yloxycarbonylanilino)pentanoate Traditional Name: 5-(4-cyanophenyl)-3-(N-quinazolin-7-yloxycarbonylanilino)valeric acid methyl ester Formula: C28H24N4O4 MolecularWeight: 480.51456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CCC1=CC=C(C=C1)C#N)N(C2=CC=CC=C2)C(=O)OC3=CC4=NC=NC=C4C=C3

Isomeric SMILES

COC(=O)CC(CCC1=CC=C(C=C1)C#N)N(C2=CC=CC=C2)C(=O)OC3=CC4=NC=NC=C4C=C3

InChI

InChI=1S/C28H24N4O4/c1-35-27(33)15-24(13-11-20-7-9-21(17-29)10-8-20)32(23-5-3-2-4-6-23)28(34)36-25-14-12-22-18-30-19-31-26(22)16-25/h2-10,12,14,16,18-19,24H,11,13,15H2,1H3