[(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-(cyclopropylmethyl)azanium

Systemtic Name: [(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-(cyclopropylmethyl)azanium Openeye Name: [(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-(cyclopropylmethyl)ammonium CAS Name: [(1S)-1-[2-(1-azocanyl)-4-methyl-5-pyrimidinyl]ethyl]-(cyclopropylmethyl)ammonium IUPAC Name: [(1S)-1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]ethyl]-(cyclopropylmethyl)azanium Traditional Name: [(1S)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]-(cyclopropylmethyl)ammonium Formula: C18H31N4+ MolecularWeight: 303.46554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)[NH2+]CC2CC2)N3CCCCCCC3

Isomeric SMILES

CC1=NC(=NC=C1[C@H](C)[NH2+]CC2CC2)N3CCCCCCC3

InChI

InChI=1S/C18H30N4/c1-14(19-12-16-8-9-16)17-13-20-18(21-15(17)2)22-10-6-4-3-5-7-11-22/h13-14,16,19H,3-12H2,1-2H3/p+1/t14-/m0/s1