[(2S)-2-(4-methylpentyl)morpholin-4-yl]-(3-methyl-1-propyl-pyrazol-4-yl)methanone

Systemtic Name: [(2S)-2-(4-methylpentyl)morpholin-4-yl]-(3-methyl-1-propyl-pyrazol-4-yl)methanone Openeye Name: [(2S)-2-isohexylmorpholin-4-yl]-(3-methyl-1-propyl-pyrazol-4-yl)methanone CAS Name: [(2S)-2-(4-methylpentyl)-4-morpholinyl]-(3-methyl-1-propyl-4-pyrazolyl)methanone IUPAC Name: [(2S)-2-(4-methylpentyl)morpholin-4-yl]-(3-methyl-1-propylpyrazol-4-yl)methanone Traditional Name: [(2S)-2-isohexylmorpholino]-(3-methyl-1-propyl-pyrazol-4-yl)methanone Formula: C18H31N3O2 MolecularWeight: 321.45764

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)C(=O)N2CCOC(C2)CCCC(C)C

Isomeric SMILES

CCCN1C=C(C(=N1)C)C(=O)N2CCO[C@H](C2)CCCC(C)C

InChI

InChI=1S/C18H31N3O2/c1-5-9-21-13-17(15(4)19-21)18(22)20-10-11-23-16(12-20)8-6-7-14(2)3/h13-14,16H,5-12H2,1-4H3/t16-/m0/s1