(7Z)-2-(dimethylaminomethyl)-2-ethynyl-7-[(3-methoxyphenyl)methylidene]-1-phenyl-cycloheptan-1-ol

Systemtic Name: (7Z)-2-(dimethylaminomethyl)-2-ethynyl-7-[(3-methoxyphenyl)methylidene]-1-phenyl-cycloheptan-1-ol Openeye Name: (7Z)-2-(dimethylaminomethyl)-2-ethynyl-7-[(3-methoxyphenyl)methylene]-1-phenyl-cycloheptanol CAS Name: (7Z)-2-(dimethylaminomethyl)-2-ethynyl-7-[(3-methoxyphenyl)methylidene]-1-phenyl-1-cycloheptanol IUPAC Name: (7Z)-2-(dimethylaminomethyl)-2-ethynyl-7-[(3-methoxyphenyl)methylidene]-1-phenylcycloheptan-1-ol Traditional Name: (7Z)-2-(dimethylaminomethyl)-2-ethynyl-7-m-anisylidene-1-phenyl-cycloheptanol Formula: C26H31NO2 MolecularWeight: 389.52984

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1(CCCCC(=CC2=CC(=CC=C2)OC)C1(C3=CC=CC=C3)O)C#C

Isomeric SMILES

CN(C)CC1(CCCC/C(=C/C2=CC(=CC=C2)OC)/C1(C3=CC=CC=C3)O)C#C

InChI

InChI=1S/C26H31NO2/c1-5-25(20-27(2)3)17-10-9-15-23(18-21-12-11-16-24(19-21)29-4)26(25,28)22-13-7-6-8-14-22/h1,6-8,11-14,16,18-19,28H,9-10,15,17,20H2,2-4H3/b23-18-