(3S)-5-methyl-1-[3-(2-methylphenoxy)propyl]-3-oxidanyl-3-(2-oxidanylidenepropyl)indol-2-one

Systemtic Name: (3S)-5-methyl-1-[3-(2-methylphenoxy)propyl]-3-oxidanyl-3-(2-oxidanylidenepropyl)indol-2-one Openeye Name: (3S)-3-acetonyl-3-hydroxy-5-methyl-1-[3-(2-methylphenoxy)propyl]indolin-2-one CAS Name: (3S)-3-hydroxy-5-methyl-1-[3-(2-methylphenoxy)propyl]-3-(2-oxopropyl)-2-indolone IUPAC Name: (3S)-3-hydroxy-5-methyl-1-[3-(2-methylphenoxy)propyl]-3-(2-oxopropyl)indol-2-one Traditional Name: (3S)-3-acetonyl-3-hydroxy-5-methyl-1-[3-(2-methylphenoxy)propyl]oxindole Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2(CC(=O)C)O)CCCOC3=CC=CC=C3C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)[C@@]2(CC(=O)C)O)CCCOC3=CC=CC=C3C

InChI

InChI=1S/C22H25NO4/c1-15-9-10-19-18(13-15)22(26,14-17(3)24)21(25)23(19)11-6-12-27-20-8-5-4-7-16(20)2/h4-5,7-10,13,26H,6,11-12,14H2,1-3H3/t22-/m0/s1