2-[(4S)-2,2-dimethyl-4-propan-2-yl-oxan-4-yl]ethyl-[(E)-3-phenylprop-2-enyl]azanium

Systemtic Name: 2-[(4S)-2,2-dimethyl-4-propan-2-yl-oxan-4-yl]ethyl-[(E)-3-phenylprop-2-enyl]azanium Openeye Name: [(E)-cinnamyl]-[2-[(4S)-4-isopropyl-2,2-dimethyl-tetrahydropyran-4-yl]ethyl]ammonium CAS Name: 2-[(4S)-2,2-dimethyl-4-propan-2-yl-4-oxanyl]ethyl-[(E)-3-phenylprop-2-enyl]ammonium IUPAC Name: 2-[(4S)-2,2-dimethyl-4-propan-2-yloxan-4-yl]ethyl-[(E)-3-phenylprop-2-enyl]azanium Traditional Name: [(E)-cinnamyl]-[2-[(4S)-4-isopropyl-2,2-dimethyl-tetrahydropyran-4-yl]ethyl]ammonium Formula: C21H34NO+ MolecularWeight: 316.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CCOC(C1)(C)C)CC[NH2+]CC=CC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@]1(CCOC(C1)(C)C)CC[NH2+]C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H33NO/c1-18(2)21(13-16-23-20(3,4)17-21)12-15-22-14-8-11-19-9-6-5-7-10-19/h5-11,18,22H,12-17H2,1-4H3/p+1/b11-8+/t21-/m0/s1