bicyclo[3.1.0]hexa-1(6),2,4-triene; [3-(3-cyclopentyloxy-4-methoxy-phenyl)-1-ethynyl-cyclobutyl]methanamine

Systemtic Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; [3-(3-cyclopentyloxy-4-methoxy-phenyl)-1-ethynyl-cyclobutyl]methanamine Openeye Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; [3-[3-(cyclopentoxy)-4-methoxy-phenyl]-1-ethynyl-cyclobutyl]methanamine CAS Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; [3-(3-cyclopentyloxy-4-methoxyphenyl)-1-ethynylcyclobutyl]methanamine IUPAC Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; [3-(3-cyclopentyloxy-4-methoxyphenyl)-1-ethynylcyclobutyl]methanamine Traditional Name: bicyclo[3.1.0]hexa-1(6),2,4-triene; [3-[3-(cyclopentoxy)-4-methoxy-phenyl]-1-ethynyl-cyclobutyl]methylamine Formula: C25H29NO2 MolecularWeight: 375.50326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(C2)(CN)C#C)OC3CCCC3.C1=CC2=CC2=C1

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(C2)(CN)C#C)OC3CCCC3.C1=CC2=CC2=C1

InChI

InChI=1S/C19H25NO2.C6H4/c1-3-19(13-20)11-15(12-19)14-8-9-17(21-2)18(10-14)22-16-6-4-5-7-16;1-2-5-4-6(5)3-1/h1,8-10,15-16H,4-7,11-13,20H2,2H3;1-4H