(3Z,5Z,7Z)-azocine; 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol

Systemtic Name: (3Z,5Z,7Z)-azocine; 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol Openeye Name: (3Z,5Z,7Z)-azocine; 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexanol CAS Name: (3Z,5Z,7Z)-azocine; 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)-1-cyclohexanol IUPAC Name: (3Z,5Z,7Z)-azocine; 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexan-1-ol Traditional Name: (3Z,5Z,7Z)-azocine; 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)cyclohexanol Formula: C51H60N6O2 MolecularWeight: 789.0611

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCCC1(C2=CC(=CC=C2)OC)O.C1=CC=CN=CC=C1.C1=CC=CN=CC=C1.C1=CC=CN=CC=C1.C1=CC=CN=CC=C1.C1=CC=CN=CC=C1

Isomeric SMILES

CN(CC1C(CCCC1)(O)C2=CC(=CC=C2)OC)C.C\1=C\C=C/N=C\C=C1.C\1=C\C=C/N=C\C=C1.C\1=C\C=C/N=C\C=C1.C\1=C\C=C/N=C\C=C1.C\1=C\C=C/N=C\C=C1

InChI

InChI=1S/C16H25NO2.5C7H7N/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3;5*1-2-4-6-8-7-5-3-1/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3;5*1-7H/b;5*2-1-,3-1?,4-2?,5-3-,6-4-,7-5?,8-6?,8-7?