2-(3,4-dihydro-1H-isoquinolin-2-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5,6,7,8-tetrahydroquinazoline-4-carboxylate Formula: C18H18N3O2- MolecularWeight: 308.35442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC(=NC(=C2C1)C(=O)[O-])N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCC2=NC(=NC(=C2C1)C(=O)[O-])N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C18H19N3O2/c22-17(23)16-14-7-3-4-8-15(14)19-18(20-16)21-10-9-12-5-1-2-6-13(12)11-21/h1-2,5-6H,3-4,7-11H2,(H,22,23)/p-1