[3-(quinazolin-4-ylamino)phenyl] 2-methylbenzoate

Systemtic Name: [3-(quinazolin-4-ylamino)phenyl] 2-methylbenzoate Openeye Name: [3-(quinazolin-4-ylamino)phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [3-(4-quinazolinylamino)phenyl] ester IUPAC Name: [3-(quinazolin-4-ylamino)phenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [3-(quinazolin-4-ylamino)phenyl] ester Formula: C22H17N3O2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=CC=CC(=C2)NC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=CC=CC(=C2)NC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C22H17N3O2/c1-15-7-2-3-10-18(15)22(26)27-17-9-6-8-16(13-17)25-21-19-11-4-5-12-20(19)23-14-24-21/h2-14H,1H3,(H,23,24,25)