3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-7-phenyl-quinazolin-4-one

Systemtic Name: 3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-7-phenyl-quinazolin-4-one Openeye Name: 3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-7-phenyl-quinazolin-4-one CAS Name: 3-[3-methoxy-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-7-phenyl-4-quinazolinone IUPAC Name: 3-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-7-phenylquinazolin-4-one Traditional Name: 3-[3-methoxy-4-(2-pyrrolidinoethoxy)phenyl]-7-phenyl-quinazolin-4-one Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27N3O3/c1-32-26-18-22(10-12-25(26)33-16-15-29-13-5-6-14-29)30-19-28-24-17-21(9-11-23(24)27(30)31)20-7-3-2-4-8-20/h2-4,7-12,17-19H,5-6,13-16H2,1H3