1-(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)piperidine-4-carboxylic acid Openeye Name: 1-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)piperidine-4-carboxylic acid CAS Name: 1-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)-4-piperidinecarboxylic acid IUPAC Name: 1-(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)piperidine-4-carboxylic acid Traditional Name: 1-(4-keto-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)isonipecotic acid Formula: C14H19N3O3 MolecularWeight: 277.31896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)N=C(N2)N3CCC(CC3)C(=O)O

Isomeric SMILES

C1CCC2=C(C1)C(=O)N=C(N2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C14H19N3O3/c18-12-10-3-1-2-4-11(10)15-14(16-12)17-7-5-9(6-8-17)13(19)20/h9H,1-8H2,(H,19,20)(H,15,16,18)