(3R,4R)-4-(azepan-1-yl)-1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidin-3-ol

Systemtic Name: (3R,4R)-4-(azepan-1-yl)-1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidin-3-ol Openeye Name: (3R,4R)-4-(azepan-1-yl)-1-[(E)-2-methyl-3-phenyl-allyl]piperidin-3-ol CAS Name: (3R,4R)-4-(1-azepanyl)-1-[(E)-2-methyl-3-phenylprop-2-enyl]-3-piperidinol IUPAC Name: (3R,4R)-4-(azepan-1-yl)-1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-3-ol Traditional Name: (3R,4R)-4-(azepan-1-yl)-1-[(E)-2-methyl-3-phenyl-allyl]piperidin-3-ol Formula: C21H32N2O MolecularWeight: 328.49158

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)CN2CCC(C(C2)O)N3CCCCCC3

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/CN2CC[C@H]([C@@H](C2)O)N3CCCCCC3

InChI

InChI=1S/C21H32N2O/c1-18(15-19-9-5-4-6-10-19)16-22-14-11-20(21(24)17-22)23-12-7-2-3-8-13-23/h4-6,9-10,15,20-21,24H,2-3,7-8,11-14,16-17H2,1H3/b18-15+/t20-,21-/m1/s1