(2S)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-4-methyl-2-[(phenylmethoxyamino)methyl]pentan-1-one

Systemtic Name: (2S)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-4-methyl-2-[(phenylmethoxyamino)methyl]pentan-1-one Openeye Name: (2S)-2-[(benzyloxyamino)methyl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]-4-methyl-pentan-1-one CAS Name: (2S)-1-[4-(4-methoxyphenyl)-1-piperazinyl]-4-methyl-2-[(phenylmethoxyamino)methyl]-1-pentanone IUPAC Name: (2S)-1-[4-(4-methoxyphenyl)piperazin-1-yl]-4-methyl-2-[(phenylmethoxyamino)methyl]pentan-1-one Traditional Name: (2S)-2-[(benzoxyamino)methyl]-1-[4-(4-methoxyphenyl)piperazino]-4-methyl-pentan-1-one Formula: C25H35N3O3 MolecularWeight: 425.5637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNOCC1=CC=CC=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C[C@@H](CNOCC1=CC=CC=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C25H35N3O3/c1-20(2)17-22(18-26-31-19-21-7-5-4-6-8-21)25(29)28-15-13-27(14-16-28)23-9-11-24(30-3)12-10-23/h4-12,20,22,26H,13-19H2,1-3H3/t22-/m0/s1