3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-6-phenoxy-quinazolin-4-one

Systemtic Name: 3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-6-phenoxy-quinazolin-4-one Openeye Name: 3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-6-phenoxy-quinazolin-4-one CAS Name: 3-[3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-6-phenoxy-4-quinazolinone IUPAC Name: 3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-6-phenoxyquinazolin-4-one Traditional Name: 3-[3-methoxy-4-(2-pyrrolidinoethoxy)phenyl]-6-phenoxy-quinazolin-4-one Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2C=NC3=C(C2=O)C=C(C=C3)OC4=CC=CC=C4)OCCN5CCCC5

Isomeric SMILES

COC1=C(C=CC(=C1)N2C=NC3=C(C2=O)C=C(C=C3)OC4=CC=CC=C4)OCCN5CCCC5

InChI

InChI=1S/C27H27N3O4/c1-32-26-17-20(9-12-25(26)33-16-15-29-13-5-6-14-29)30-19-28-24-11-10-22(18-23(24)27(30)31)34-21-7-3-2-4-8-21/h2-4,7-12,17-19H,5-6,13-16H2,1H3