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cyclohexyl-[(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]azanium

cyclohexyl-[(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]azanium

Systemtic Name:cyclohexyl-[(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]azanium
Openeye Name:cyclohexyl-[(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]ammonium
CAS Name:cyclohexyl-[(4S)-1-(4,7-dimethyl-2-quinazolinyl)-4-azepanyl]ammonium
IUPAC Name:cyclohexyl-[(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]azanium
Traditional Name:cyclohexyl-[(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]ammonium
Formula: C22H33N4+
MolecularWeight: 353.52422
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)[NH2+]C4CCCCC4)C


Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCC[C@@H](CC3)[NH2+]C4CCCCC4)C


InChI

InChI=1S/C22H32N4/c1-16-10-11-20-17(2)23-22(25-21(20)15-16)26-13-6-9-19(12-14-26)24-18-7-4-3-5-8-18/h10-11,15,18-19,24H,3-9,12-14H2,1-2H3/p+1/t19-/m0/s1


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