3-ethyl-2-phenyl-spiro[4a,6-dihydrobenzo[h]quinazolin-3-ium-5,1'-cyclohexane]-4-one

Systemtic Name: 3-ethyl-2-phenyl-spiro[4a,6-dihydrobenzo[h]quinazolin-3-ium-5,1'-cyclohexane]-4-one Openeye Name: 3-ethyl-2-phenyl-spiro[4a,6-dihydrobenzo[h]quinazolin-3-ium-5,1'-cyclohexane]-4-one CAS Name: 3-ethyl-2-phenyl-4-spiro[4a,6-dihydrobenzo[h]quinazolin-3-ium-5,1'-cyclohexane]one IUPAC Name: 3-ethyl-2-phenylspiro[4a,6-dihydrobenzo[h]quinazolin-3-ium-5,1'-cyclohexane]-4-one Traditional Name: 3-ethyl-2-phenyl-spiro[4a,6-dihydrobenzo[h]quinazolin-3-ium-5,1'-cyclohexane]-4-one Formula: C25H27N2O+ MolecularWeight: 371.49468

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N=C2C(C1=O)C3(CCCCC3)CC4=CC=CC=C42)C5=CC=CC=C5

Isomeric SMILES

CC[N+]1=C(N=C2C(C1=O)C3(CCCCC3)CC4=CC=CC=C42)C5=CC=CC=C5

InChI

InChI=1S/C25H27N2O/c1-2-27-23(18-11-5-3-6-12-18)26-22-20-14-8-7-13-19(20)17-25(21(22)24(27)28)15-9-4-10-16-25/h3,5-8,11-14,21H,2,4,9-10,15-17H2,1H3/q+1