methyl 2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-ethyl-amino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1COC2=CC=CC=C2O1)CC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

Isomeric SMILES

CCN(C[C@H]1COC2=CC=CC=C2O1)CC3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)OC

InChI

InChI=1S/C22H23N3O5/c1-3-25(11-15-13-29-18-6-4-5-7-19(18)30-15)12-20-23-17-10-14(22(27)28-2)8-9-16(17)21(26)24-20/h4-10,15H,3,11-13H2,1-2H3,(H,23,24,26)/t15-/m0/s1