(4-azanyl-2-cyclohexyl-phenyl) 2-oxidanylhex-4-ynoate

Systemtic Name: (4-azanyl-2-cyclohexyl-phenyl) 2-oxidanylhex-4-ynoate Openeye Name: (4-amino-2-cyclohexyl-phenyl) 2-hydroxyhex-4-ynoate CAS Name: 2-hydroxy-4-hexynoic acid (4-amino-2-cyclohexylphenyl) ester IUPAC Name: (4-amino-2-cyclohexylphenyl) 2-hydroxyhex-4-ynoate Traditional Name: 2-hydroxyhex-4-ynoic acid (4-amino-2-cyclohexyl-phenyl) ester Formula: C18H23NO3 MolecularWeight: 301.38012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(C(=O)OC1=C(C=C(C=C1)N)C2CCCCC2)O

Isomeric SMILES

CC#CCC(C(=O)OC1=C(C=C(C=C1)N)C2CCCCC2)O

InChI

InChI=1S/C18H23NO3/c1-2-3-9-16(20)18(21)22-17-11-10-14(19)12-15(17)13-7-5-4-6-8-13/h10-13,16,20H,4-9,19H2,1H3