(2R)-2-[[(2R,3S)-2-(2-methoxyphenyl)azepan-3-yl]amino]-2-phenyl-ethanol

Systemtic Name: (2R)-2-[[(2R,3S)-2-(2-methoxyphenyl)azepan-3-yl]amino]-2-phenyl-ethanol Openeye Name: (2R)-2-[[(2R,3S)-2-(2-methoxyphenyl)azepan-3-yl]amino]-2-phenyl-ethanol CAS Name: (2R)-2-[[(2R,3S)-2-(2-methoxyphenyl)-3-azepanyl]amino]-2-phenylethanol IUPAC Name: (2R)-2-[[(2R,3S)-2-(2-methoxyphenyl)azepan-3-yl]amino]-2-phenylethanol Traditional Name: (2R)-2-[[(2R,3S)-2-(2-methoxyphenyl)azepan-3-yl]amino]-2-phenyl-ethanol Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2C(CCCCN2)NC(CO)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1[C@@H]2[C@H](CCCCN2)N[C@@H](CO)C3=CC=CC=C3

InChI

InChI=1S/C21H28N2O2/c1-25-20-13-6-5-11-17(20)21-18(12-7-8-14-22-21)23-19(15-24)16-9-3-2-4-10-16/h2-6,9-11,13,18-19,21-24H,7-8,12,14-15H2,1H3/t18-,19-,21+/m0/s1