methyl 2-[4-[(2-butyl-6-methyl-4-oxidanylidene-quinazolin-3-yl)methyl]-2-chloranyl-phenoxy]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[4-[(2-butyl-6-methyl-4-oxidanylidene-quinazolin-3-yl)methyl]-2-chloranyl-phenoxy]-2-phenyl-ethanoate Openeye Name: methyl 2-[4-[(2-butyl-6-methyl-4-oxo-quinazolin-3-yl)methyl]-2-chloro-phenoxy]-2-phenyl-acetate CAS Name: 2-[4-[(2-butyl-6-methyl-4-oxo-3-quinazolinyl)methyl]-2-chlorophenoxy]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[4-[(2-butyl-6-methyl-4-oxoquinazolin-3-yl)methyl]-2-chlorophenoxy]-2-phenylacetate Traditional Name: 2-[4-[(2-butyl-4-keto-6-methyl-quinazolin-3-yl)methyl]-2-chloro-phenoxy]-2-phenyl-acetic acid methyl ester Formula: C29H29ClN2O4 MolecularWeight: 505.00456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C(C=C2)C)C(=O)N1CC3=CC(=C(C=C3)OC(C4=CC=CC=C4)C(=O)OC)Cl

Isomeric SMILES

CCCCC1=NC2=C(C=C(C=C2)C)C(=O)N1CC3=CC(=C(C=C3)OC(C4=CC=CC=C4)C(=O)OC)Cl

InChI

InChI=1S/C29H29ClN2O4/c1-4-5-11-26-31-24-14-12-19(2)16-22(24)28(33)32(26)18-20-13-15-25(23(30)17-20)36-27(29(34)35-3)21-9-7-6-8-10-21/h6-10,12-17,27H,4-5,11,18H2,1-3H3