(3S)-3-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-1-[(4-methylphenyl)methyl]-3-oxidanyl-indol-2-one

Systemtic Name: (3S)-3-[2-(1-adamantyl)-2-oxidanylidene-ethyl]-1-[(4-methylphenyl)methyl]-3-oxidanyl-indol-2-one Openeye Name: (3S)-3-[2-(1-adamantyl)-2-oxo-ethyl]-3-hydroxy-1-(p-tolylmethyl)indolin-2-one CAS Name: (3S)-3-[2-(1-adamantyl)-2-oxoethyl]-3-hydroxy-1-[(4-methylphenyl)methyl]-2-indolone IUPAC Name: (3S)-3-[2-(1-adamantyl)-2-oxoethyl]-3-hydroxy-1-[(4-methylphenyl)methyl]indol-2-one Traditional Name: (3S)-3-[2-(1-adamantyl)-2-keto-ethyl]-3-hydroxy-1-(4-methylbenzyl)oxindole Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C45CC6CC(C4)CC(C6)C5)O

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=CC=CC=C3[C@](C2=O)(CC(=O)C45CC6CC(C4)CC(C6)C5)O

InChI

InChI=1S/C28H31NO3/c1-18-6-8-19(9-7-18)17-29-24-5-3-2-4-23(24)28(32,26(29)31)16-25(30)27-13-20-10-21(14-27)12-22(11-20)15-27/h2-9,20-22,32H,10-17H2,1H3/t20?,21?,22?,27?,28-/m0/s1