methyl 8-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-2-pyrrol-1-yl-oct-4-ynoate

Systemtic Name: methyl 8-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-2-pyrrol-1-yl-oct-4-ynoate Openeye Name: methyl 8-(5-methyl-2-phenyl-oxazol-4-yl)-2-pyrrol-1-yl-oct-4-ynoate CAS Name: 8-(5-methyl-2-phenyl-4-oxazolyl)-2-(1-pyrrolyl)-4-octynoic acid methyl ester IUPAC Name: methyl 8-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-2-pyrrol-1-yloct-4-ynoate Traditional Name: 8-(5-methyl-2-phenyl-oxazol-4-yl)-2-pyrrol-1-yl-oct-4-ynoic acid methyl ester Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CCCC#CCC(C(=O)OC)N3C=CC=C3

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CCCC#CCC(C(=O)OC)N3C=CC=C3

InChI

InChI=1S/C23H24N2O3/c1-18-20(24-22(28-18)19-12-6-5-7-13-19)14-8-3-4-9-15-21(23(26)27-2)25-16-10-11-17-25/h5-7,10-13,16-17,21H,3,8,14-15H2,1-2H3