3-[[(4aS,8aS)-7-chloranyl-4a,8a-dihydroquinazolin-4-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[(4aS,8aS)-7-chloranyl-4a,8a-dihydroquinazolin-4-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[(4aS,8aS)-7-chloro-4a,8a-dihydroquinazolin-4-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[(4aS,8aS)-7-chloro-4a,8a-dihydroquinazolin-4-yl]amino]propyl-dimethylammonium IUPAC Name: 3-[[(4aS,8aS)-7-chloro-4a,8a-dihydroquinazolin-4-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[(4aS,8aS)-7-chloro-4a,8a-dihydroquinazolin-4-yl]amino]propyl-dimethyl-ammonium Formula: C13H20ClN4+ MolecularWeight: 267.7777

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=NC=NC2C1C=CC(=C2)Cl

Isomeric SMILES

C[NH+](C)CCCNC1=NC=N[C@H]2[C@@H]1C=CC(=C2)Cl

InChI

InChI=1S/C13H19ClN4/c1-18(2)7-3-6-15-13-11-5-4-10(14)8-12(11)16-9-17-13/h4-5,8-9,11-12H,3,6-7H2,1-2H3,(H,15,16,17)/p+1/t11-,12+/m0/s1