methyl 2-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[(4-allyloxyphenyl)methyl-methyl-amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[methyl-[(4-prop-2-enoxyphenyl)methyl]amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[(4-allyloxybenzyl)-methyl-amino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OCC=C)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CN(CC1=CC=C(C=C1)OCC=C)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H23N3O4/c1-4-11-29-17-8-5-15(6-9-17)13-25(2)14-20-23-19-12-16(22(27)28-3)7-10-18(19)21(26)24-20/h4-10,12H,1,11,13-14H2,2-3H3,(H,23,24,26)