bicyclo[2.2.0]hexa-1(4),2,5-triene; N-ethynyl-N-methyl-4-phenyl-heptan-4-amine

Systemtic Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; N-ethynyl-N-methyl-4-phenyl-heptan-4-amine Openeye Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; N-ethynyl-N-methyl-4-phenyl-heptan-4-amine CAS Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; N-ethynyl-N-methyl-4-phenyl-4-heptanamine IUPAC Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; N-ethynyl-N-methyl-4-phenylheptan-4-amine Traditional Name: bicyclo[2.2.0]hexa-1(4),2,5-triene; ethynyl-methyl-(1-phenyl-1-propyl-butyl)amine Formula: C22H27N MolecularWeight: 305.45648

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C1=CC=CC=C1)N(C)C#C.C1=CC2=C1C=C2

Isomeric SMILES

CCCC(CCC)(C1=CC=CC=C1)N(C)C#C.C1=CC2=C1C=C2

InChI

InChI=1S/C16H23N.C6H4/c1-5-13-16(14-6-2,17(4)7-3)15-11-9-8-10-12-15;1-2-6-4-3-5(1)6/h3,8-12H,5-6,13-14H2,1-2,4H3;1-4H