methyl 4-[(E)-3-oxidanylidene-3-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl-(oxolan-2-ylmethyl)amino]prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-oxidanylidene-3-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl-(oxolan-2-ylmethyl)amino]prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-oxo-3-[(4-oxo-1H-quinazolin-2-yl)methyl-(tetrahydrofuran-2-ylmethyl)amino]prop-1-enyl]benzoate CAS Name: 4-[(E)-3-oxo-3-[2-oxolanylmethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]prop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-oxo-3-[oxolan-2-ylmethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]prop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-[(4-keto-1H-quinazolin-2-yl)methyl-(tetrahydrofurfuryl)amino]prop-1-enyl]benzoic acid methyl ester Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CC(=O)N(CC2CCCO2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/C(=O)N(CC2CCCO2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H25N3O5/c1-32-25(31)18-11-8-17(9-12-18)10-13-23(29)28(15-19-5-4-14-33-19)16-22-26-21-7-3-2-6-20(21)24(30)27-22/h2-3,6-13,19H,4-5,14-16H2,1H3,(H,26,27,30)/b13-10+