5-chloranyl-1'-(4-hexylphenyl)carbonyl-spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one

Systemtic Name: 5-chloranyl-1'-(4-hexylphenyl)carbonyl-spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one Openeye Name: 5-chloro-1'-(4-hexylbenzoyl)spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one CAS Name: 5-chloro-1'-[(4-hexylphenyl)-oxomethyl]-4-spiro[1,3-dihydroquinazoline-2,4'-piperidine]one IUPAC Name: 5-chloro-1'-(4-hexylbenzoyl)spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one Traditional Name: 5-chloro-1'-(4-hexylbenzoyl)spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one Formula: C25H30ClN3O2 MolecularWeight: 439.9776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)NC4=C(C(=CC=C4)Cl)C(=O)N3

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)NC4=C(C(=CC=C4)Cl)C(=O)N3

InChI

InChI=1S/C25H30ClN3O2/c1-2-3-4-5-7-18-10-12-19(13-11-18)24(31)29-16-14-25(15-17-29)27-21-9-6-8-20(26)22(21)23(30)28-25/h6,8-13,27H,2-5,7,14-17H2,1H3,(H,28,30)