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

Systemtic Name: (3S)-5-chloranyl-1-[3-(2-methylphenoxy)propyl]-3-oxidanyl-3-(2-oxidanylidenepropyl)indol-2-one Openeye Name: (3S)-3-acetonyl-5-chloro-3-hydroxy-1-[3-(2-methylphenoxy)propyl]indolin-2-one CAS Name: (3S)-5-chloro-3-hydroxy-1-[3-(2-methylphenoxy)propyl]-3-(2-oxopropyl)-2-indolone IUPAC Name: (3S)-5-chloro-3-hydroxy-1-[3-(2-methylphenoxy)propyl]-3-(2-oxopropyl)indol-2-one Traditional Name: (3S)-3-acetonyl-5-chloro-3-hydroxy-1-[3-(2-methylphenoxy)propyl]oxindole Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCN2C3=C(C=C(C=C3)Cl)C(C2=O)(CC(=O)C)O

Isomeric SMILES

CC1=CC=CC=C1OCCCN2C3=C(C=C(C=C3)Cl)[C@](C2=O)(CC(=O)C)O

InChI

InChI=1S/C21H22ClNO4/c1-14-6-3-4-7-19(14)27-11-5-10-23-18-9-8-16(22)12-17(18)21(26,20(23)25)13-15(2)24/h3-4,6-9,12,26H,5,10-11,13H2,1-2H3/t21-/m0/s1