[(5S)-7,7-dimethyl-2-(4-oxidanylpiperidin-1-yl)-6,8-dihydro-5H-quinazolin-5-yl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: [(5S)-7,7-dimethyl-2-(4-oxidanylpiperidin-1-yl)-6,8-dihydro-5H-quinazolin-5-yl]-(pyridin-3-ylmethyl)azanium Openeye Name: [(5S)-2-(4-hydroxy-1-piperidyl)-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(3-pyridylmethyl)ammonium CAS Name: [(5S)-2-(4-hydroxy-1-piperidinyl)-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(3-pyridinylmethyl)ammonium IUPAC Name: [(5S)-2-(4-hydroxypiperidin-1-yl)-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(pyridin-3-ylmethyl)azanium Traditional Name: [(5S)-2-(4-hydroxypiperidino)-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-(3-pyridylmethyl)ammonium Formula: C21H30N5O+ MolecularWeight: 368.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=CN=C(N=C2C1)N3CCC(CC3)O)[NH2+]CC4=CN=CC=C4)C

Isomeric SMILES

CC1(C[C@@H](C2=CN=C(N=C2C1)N3CCC(CC3)O)[NH2+]CC4=CN=CC=C4)C

InChI

InChI=1S/C21H29N5O/c1-21(2)10-18(23-13-15-4-3-7-22-12-15)17-14-24-20(25-19(17)11-21)26-8-5-16(27)6-9-26/h3-4,7,12,14,16,18,23,27H,5-6,8-11,13H2,1-2H3/p+1/t18-/m0/s1