1-propan-2-yl-N-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]piperidin-1-ium-4-amine

Systemtic Name: 1-propan-2-yl-N-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]piperidin-1-ium-4-amine Openeye Name: 1-isopropyl-N-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]piperidin-1-ium-4-amine CAS Name: 1-propan-2-yl-N-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]-4-piperidin-1-iumamine IUPAC Name: 1-propan-2-yl-N-[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]piperidin-1-ium-4-amine Traditional Name: (1-isopropylpiperidin-1-ium-4-yl)-[(4S)-4,5,6,7-tetrahydrobenzofuran-4-yl]amine Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC2CCCC3=C2C=CO3

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)N[C@H]2CCCC3=C2C=CO3

InChI

InChI=1S/C16H26N2O/c1-12(2)18-9-6-13(7-10-18)17-15-4-3-5-16-14(15)8-11-19-16/h8,11-13,15,17H,3-7,9-10H2,1-2H3/p+1/t15-/m0/s1