(3R,4S)-3-[3-(4-butylphenyl)prop-2-ynyl]-4-(4-methoxyphenyl)-1-phenyl-azetidin-2-one

Systemtic Name: (3R,4S)-3-[3-(4-butylphenyl)prop-2-ynyl]-4-(4-methoxyphenyl)-1-phenyl-azetidin-2-one Openeye Name: (3R,4S)-3-[3-(4-butylphenyl)prop-2-ynyl]-4-(4-methoxyphenyl)-1-phenyl-azetidin-2-one CAS Name: (3R,4S)-3-[3-(4-butylphenyl)prop-2-ynyl]-4-(4-methoxyphenyl)-1-phenyl-2-azetidinone IUPAC Name: (3R,4S)-3-[3-(4-butylphenyl)prop-2-ynyl]-4-(4-methoxyphenyl)-1-phenylazetidin-2-one Traditional Name: (3R,4S)-3-[3-(4-butylphenyl)prop-2-ynyl]-4-(4-methoxyphenyl)-1-phenyl-azetidin-2-one Formula: C29H29NO2 MolecularWeight: 423.54606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CCC2C(N(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#CC[C@@H]2[C@H](N(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C29H29NO2/c1-3-4-9-22-14-16-23(17-15-22)10-8-13-27-28(24-18-20-26(32-2)21-19-24)30(29(27)31)25-11-6-5-7-12-25/h5-7,11-12,14-21,27-28H,3-4,9,13H2,1-2H3/t27-,28-/m1/s1