3-azanyl-5-methoxy-1-oxidanyl-2-(6-phenylhexan-3-yl)-3H-pyrazole-4-carbonitrile

Systemtic Name: 3-azanyl-5-methoxy-1-oxidanyl-2-(6-phenylhexan-3-yl)-3H-pyrazole-4-carbonitrile Openeye Name: 3-amino-2-(1-ethyl-4-phenyl-butyl)-1-hydroxy-5-methoxy-3H-pyrazole-4-carbonitrile CAS Name: 3-amino-1-hydroxy-5-methoxy-2-(6-phenylhexan-3-yl)-3H-pyrazole-4-carbonitrile IUPAC Name: 3-amino-1-hydroxy-5-methoxy-2-(6-phenylhexan-3-yl)-3H-pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(1-ethyl-4-phenyl-butyl)-2-hydroxy-3-methoxy-3-pyrazoline-4-carbonitrile Formula: C17H24N4O2 MolecularWeight: 316.39806

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCC1=CC=CC=C1)N2C(C(=C(N2O)OC)C#N)N

Isomeric SMILES

CCC(CCCC1=CC=CC=C1)N2C(C(=C(N2O)OC)C#N)N

InChI

InChI=1S/C17H24N4O2/c1-3-14(11-7-10-13-8-5-4-6-9-13)20-16(19)15(12-18)17(23-2)21(20)22/h4-6,8-9,14,16,22H,3,7,10-11,19H2,1-2H3