(4-azanylquinazolin-2-yl)methyl 2-(2,3-dihydroindol-1-ylcarbonyl)cyclohexane-1-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 2-(2,3-dihydroindol-1-ylcarbonyl)cyclohexane-1-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl 2-(indoline-1-carbonyl)cyclohexanecarboxylate CAS Name: 2-[2,3-dihydroindol-1-yl(oxo)methyl]-1-cyclohexanecarboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 2-(2,3-dihydroindole-1-carbonyl)cyclohexane-1-carboxylate Traditional Name: 2-(indoline-1-carbonyl)cyclohexanecarboxylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)N2CCC3=CC=CC=C32)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

Isomeric SMILES

C1CCC(C(C1)C(=O)N2CCC3=CC=CC=C32)C(=O)OCC4=NC5=CC=CC=C5C(=N4)N

InChI

InChI=1S/C25H26N4O3/c26-23-19-10-4-5-11-20(19)27-22(28-23)15-32-25(31)18-9-3-2-8-17(18)24(30)29-14-13-16-7-1-6-12-21(16)29/h1,4-7,10-12,17-18H,2-3,8-9,13-15H2,(H2,26,27,28)