[(1S,3S)-3,4-dimethyl-7-oxidanyl-2,3-dihydro-1H-inden-1-yl]-pentan-3-yl-azanium

Systemtic Name: [(1S,3S)-3,4-dimethyl-7-oxidanyl-2,3-dihydro-1H-inden-1-yl]-pentan-3-yl-azanium Openeye Name: 1-ethylpropyl-[(1S,3S)-7-hydroxy-3,4-dimethyl-indan-1-yl]ammonium CAS Name: [(1S,3S)-7-hydroxy-3,4-dimethyl-2,3-dihydro-1H-inden-1-yl]-pentan-3-ylammonium IUPAC Name: [(1S,3S)-7-hydroxy-3,4-dimethyl-2,3-dihydro-1H-inden-1-yl]-pentan-3-ylazanium Traditional Name: 1-ethylpropyl-[(1S,3S)-7-hydroxy-3,4-dimethyl-indan-1-yl]ammonium Formula: C16H26NO+ MolecularWeight: 248.38374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]C1CC(C2=C(C=CC(=C12)O)C)C

Isomeric SMILES

CCC(CC)[NH2+][C@H]1C[C@@H](C2=C(C=CC(=C12)O)C)C

InChI

InChI=1S/C16H25NO/c1-5-12(6-2)17-13-9-11(4)15-10(3)7-8-14(18)16(13)15/h7-8,11-13,17-18H,5-6,9H2,1-4H3/p+1/t11-,13-/m0/s1