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

Systemtic Name: [(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]-propan-2-yl-azanium Openeye Name: [(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]-isopropyl-ammonium CAS Name: [(4S)-1-(4,7-dimethyl-2-quinazolinyl)-4-azepanyl]-propan-2-ylammonium IUPAC Name: [(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]-propan-2-ylazanium Traditional Name: [(4S)-1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]-isopropyl-ammonium Formula: C19H29N4+ MolecularWeight: 313.46036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4/c1-13(2)20-16-6-5-10-23(11-9-16)19-21-15(4)17-8-7-14(3)12-18(17)22-19/h7-8,12-13,16,20H,5-6,9-11H2,1-4H3/p+1/t16-/m0/s1