but-3-ynyl 4-azanyl-5-fluoranyl-spiro[1H-quinazoline-2,4'-piperidine]-1'-carboxylate

Systemtic Name: but-3-ynyl 4-azanyl-5-fluoranyl-spiro[1H-quinazoline-2,4'-piperidine]-1'-carboxylate Openeye Name: but-3-ynyl 4-amino-5-fluoro-spiro[1H-quinazoline-2,4'-piperidine]-1'-carboxylate CAS Name: 4-amino-5-fluoro-1'-spiro[1H-quinazoline-2,4'-piperidine]carboxylic acid but-3-ynyl ester IUPAC Name: but-3-ynyl 4-amino-5-fluorospiro[1H-quinazoline-2,4'-piperidine]-1'-carboxylate Traditional Name: 4-amino-5-fluoro-spiro[1H-quinazoline-2,4'-piperidine]-1'-carboxylic acid but-3-ynyl ester Formula: C17H19FN4O2 MolecularWeight: 330.356763

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCOC(=O)N1CCC2(CC1)NC3=C(C(=CC=C3)F)C(=N2)N

Isomeric SMILES

C#CCCOC(=O)N1CCC2(CC1)NC3=C(C(=CC=C3)F)C(=N2)N

InChI

InChI=1S/C17H19FN4O2/c1-2-3-11-24-16(23)22-9-7-17(8-10-22)20-13-6-4-5-12(18)14(13)15(19)21-17/h1,4-6,20H,3,7-11H2,(H2,19,21)