6-iodanyl-1'-[(3-nitrophenyl)methyl]spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one

Systemtic Name: 6-iodanyl-1'-[(3-nitrophenyl)methyl]spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one Openeye Name: 6-iodo-1'-[(3-nitrophenyl)methyl]spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one CAS Name: 6-iodo-1'-[(3-nitrophenyl)methyl]-4-spiro[1,3-dihydroquinazoline-2,4'-piperidine]one IUPAC Name: 6-iodo-1'-[(3-nitrophenyl)methyl]spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one Traditional Name: 6-iodo-1'-(3-nitrobenzyl)spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one Formula: C19H19IN4O3 MolecularWeight: 478.28363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12NC3=C(C=C(C=C3)I)C(=O)N2)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC12NC3=C(C=C(C=C3)I)C(=O)N2)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H19IN4O3/c20-14-4-5-17-16(11-14)18(25)22-19(21-17)6-8-23(9-7-19)12-13-2-1-3-15(10-13)24(26)27/h1-5,10-11,21H,6-9,12H2,(H,22,25)