2-[1-(azepan-3-yl)-1-phenyl-propyl]-4-methyl-phenol

Systemtic Name: 2-[1-(azepan-3-yl)-1-phenyl-propyl]-4-methyl-phenol Openeye Name: 2-[1-(azepan-3-yl)-1-phenyl-propyl]-4-methyl-phenol CAS Name: 2-[1-(3-azepanyl)-1-phenylpropyl]-4-methylphenol IUPAC Name: 2-[1-(azepan-3-yl)-1-phenylpropyl]-4-methylphenol Traditional Name: 2-[1-(azepan-3-yl)-1-phenyl-propyl]-4-methyl-phenol Formula: C22H29NO MolecularWeight: 323.47176

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCCNC1)(C2=CC=CC=C2)C3=C(C=CC(=C3)C)O

Isomeric SMILES

CCC(C1CCCCNC1)(C2=CC=CC=C2)C3=C(C=CC(=C3)C)O

InChI

InChI=1S/C22H29NO/c1-3-22(18-9-5-4-6-10-18,19-11-7-8-14-23-16-19)20-15-17(2)12-13-21(20)24/h4-6,9-10,12-13,15,19,23-24H,3,7-8,11,14,16H2,1-2H3