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

Systemtic Name: 4-phenylbutyl 4-azanyl-5-fluoranyl-spiro[1H-quinazoline-2,4'-piperidine]-1'-carboxylate Openeye Name: 4-phenylbutyl 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 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl 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 4-phenylbutyl ester Formula: C23H27FN4O2 MolecularWeight: 410.484483

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12NC3=C(C(=CC=C3)F)C(=N2)N)C(=O)OCCCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC12NC3=C(C(=CC=C3)F)C(=N2)N)C(=O)OCCCCC4=CC=CC=C4

InChI

InChI=1S/C23H27FN4O2/c24-18-10-6-11-19-20(18)21(25)27-23(26-19)12-14-28(15-13-23)22(29)30-16-5-4-9-17-7-2-1-3-8-17/h1-3,6-8,10-11,26H,4-5,9,12-16H2,(H2,25,27)