[(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(pyridin-4-ylmethyl)azanium Openeye Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(4-pyridylmethyl)ammonium CAS Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(pyridin-4-ylmethyl)azanium Traditional Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(4-pyridylmethyl)ammonium Formula: C20H29N4+ MolecularWeight: 325.47106

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=CN=C(N=C2C1)C(C)(C)C)[NH2+]CC3=CC=NC=C3)C

Isomeric SMILES

CC1(C[C@@H](C2=CN=C(N=C2C1)C(C)(C)C)[NH2+]CC3=CC=NC=C3)C

InChI

InChI=1S/C20H28N4/c1-19(2,3)18-23-13-15-16(10-20(4,5)11-17(15)24-18)22-12-14-6-8-21-9-7-14/h6-9,13,16,22H,10-12H2,1-5H3/p+1/t16-/m0/s1