2-[4-[4-azanyl-4-(3-chlorophenyl)-2-methyl-4-oxidanyl-butoxy]phenyl]ethyl ethanoate

Systemtic Name: 2-[4-[4-azanyl-4-(3-chlorophenyl)-2-methyl-4-oxidanyl-butoxy]phenyl]ethyl ethanoate Openeye Name: 2-[4-[4-amino-4-(3-chlorophenyl)-4-hydroxy-2-methyl-butoxy]phenyl]ethyl acetate CAS Name: acetic acid 2-[4-[4-amino-4-(3-chlorophenyl)-4-hydroxy-2-methylbutoxy]phenyl]ethyl ester IUPAC Name: 2-[4-[4-amino-4-(3-chlorophenyl)-4-hydroxy-2-methylbutoxy]phenyl]ethyl acetate Traditional Name: acetic acid 2-[4-[4-amino-4-(3-chlorophenyl)-4-hydroxy-2-methyl-butoxy]phenyl]ethyl ester Formula: C21H26ClNO4 MolecularWeight: 391.88844

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=CC(=CC=C1)Cl)(N)O)COC2=CC=C(C=C2)CCOC(=O)C

Isomeric SMILES

CC(CC(C1=CC(=CC=C1)Cl)(N)O)COC2=CC=C(C=C2)CCOC(=O)C

InChI

InChI=1S/C21H26ClNO4/c1-15(13-21(23,25)18-4-3-5-19(22)12-18)14-27-20-8-6-17(7-9-20)10-11-26-16(2)24/h3-9,12,15,25H,10-11,13-14,23H2,1-2H3