2-[[(6S)-10,10-dimethyl-9-oxa-4-azoniaspiro[5.5]undecan-4-yl]methyl]spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-4-one

Systemtic Name: 2-[[(6S)-10,10-dimethyl-9-oxa-4-azoniaspiro[5.5]undecan-4-yl]methyl]spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 2-[[(6S)-10,10-dimethyl-9-oxa-4-azoniaspiro[5.5]undecan-4-yl]methyl]spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 2-[[(6S)-10,10-dimethyl-9-oxa-4-azoniaspiro[5.5]undecan-4-yl]methyl]-4-spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 2-[[(6S)-10,10-dimethyl-9-oxa-4-azoniaspiro[5.5]undecan-4-yl]methyl]spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 2-[[(6S)-10,10-dimethyl-9-oxa-4-azoniaspiro[5.5]undecan-4-yl]methyl]spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C28H38N3O2+ MolecularWeight: 448.62022

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2(CCC[NH+](C2)CC3=NC(=O)C4=C(N3)C5=CC=CC=C5CC46CCCC6)CCO1)C

Isomeric SMILES

CC1(C[C@]2(CCC[NH+](C2)CC3=NC(=O)C4=C(N3)C5=CC=CC=C5CC46CCCC6)CCO1)C

InChI

InChI=1S/C28H37N3O2/c1-26(2)18-27(13-15-33-26)10-7-14-31(19-27)17-22-29-24-21-9-4-3-8-20(21)16-28(11-5-6-12-28)23(24)25(32)30-22/h3-4,8-9H,5-7,10-19H2,1-2H3,(H,29,30,32)/p+1/t27-/m0/s1