(3R,4S)-1-(1-adamantyl)-4-(4-methoxyphenyl)-3-(3-phenylpropyl)azetidin-2-one

Systemtic Name: (3R,4S)-1-(1-adamantyl)-4-(4-methoxyphenyl)-3-(3-phenylpropyl)azetidin-2-one Openeye Name: (3R,4S)-1-(1-adamantyl)-4-(4-methoxyphenyl)-3-(3-phenylpropyl)azetidin-2-one CAS Name: (3R,4S)-1-(1-adamantyl)-4-(4-methoxyphenyl)-3-(3-phenylpropyl)-2-azetidinone IUPAC Name: (3R,4S)-1-(1-adamantyl)-4-(4-methoxyphenyl)-3-(3-phenylpropyl)azetidin-2-one Traditional Name: (3R,4S)-1-(1-adamantyl)-4-(4-methoxyphenyl)-3-(3-phenylpropyl)azetidin-2-one Formula: C29H35NO2 MolecularWeight: 429.5937

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(=O)N2C34CC5CC(C3)CC(C5)C4)CCCC6=CC=CC=C6

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2[C@H](C(=O)N2C34CC5CC(C3)CC(C5)C4)CCCC6=CC=CC=C6

InChI

InChI=1S/C29H35NO2/c1-32-25-12-10-24(11-13-25)27-26(9-5-8-20-6-3-2-4-7-20)28(31)30(27)29-17-21-14-22(18-29)16-23(15-21)19-29/h2-4,6-7,10-13,21-23,26-27H,5,8-9,14-19H2,1H3/t21?,22?,23?,26-,27-,29?/m1/s1