(2S,3S)-2-azanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-pentan-1-one

Systemtic Name: (2S,3S)-2-azanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-pentan-1-one Openeye Name: (2S,3S)-2-amino-1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-pentan-1-one CAS Name: (2S,3S)-2-amino-1-[4-(4-methoxyphenyl)-1-piperazinyl]-3-methyl-1-pentanone IUPAC Name: (2S,3S)-2-amino-1-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methylpentan-1-one Traditional Name: (2S,3S)-2-amino-1-[4-(4-methoxyphenyl)piperazino]-3-methyl-pentan-1-one Formula: C17H27N3O2 MolecularWeight: 305.41518

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)N

InChI

InChI=1S/C17H27N3O2/c1-4-13(2)16(18)17(21)20-11-9-19(10-12-20)14-5-7-15(22-3)8-6-14/h5-8,13,16H,4,9-12,18H2,1-3H3/t13-,16-/m0/s1