[4-[(2R)-3-azanyl-2-oxidanyl-propyl]piperazin-1-yl]-(3,4-dimethylphenyl)methanone

Systemtic Name: [4-[(2R)-3-azanyl-2-oxidanyl-propyl]piperazin-1-yl]-(3,4-dimethylphenyl)methanone Openeye Name: [4-[(2R)-3-amino-2-hydroxy-propyl]piperazin-1-yl]-(3,4-dimethylphenyl)methanone CAS Name: [4-[(2R)-3-amino-2-hydroxypropyl]-1-piperazinyl]-(3,4-dimethylphenyl)methanone IUPAC Name: [4-[(2R)-3-amino-2-hydroxypropyl]piperazin-1-yl]-(3,4-dimethylphenyl)methanone Traditional Name: [4-[(2R)-3-amino-2-hydroxy-propyl]piperazino]-(3,4-dimethylphenyl)methanone Formula: C16H25N3O2 MolecularWeight: 291.3886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC(CN)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C[C@@H](CN)O)C

InChI

InChI=1S/C16H25N3O2/c1-12-3-4-14(9-13(12)2)16(21)19-7-5-18(6-8-19)11-15(20)10-17/h3-4,9,15,20H,5-8,10-11,17H2,1-2H3/t15-/m1/s1