5-azanyl-4-(7-azanylheptanoyl)-1-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 5-azanyl-4-(7-azanylheptanoyl)-1-methyl-2-phenyl-pyrazol-3-one Openeye Name: 5-amino-4-(7-aminoheptanoyl)-1-methyl-2-phenyl-pyrazol-3-one CAS Name: 5-amino-4-(7-amino-1-oxoheptyl)-1-methyl-2-phenyl-3-pyrazolone IUPAC Name: 5-amino-4-(7-aminoheptanoyl)-1-methyl-2-phenylpyrazol-3-one Traditional Name: 5-amino-4-(7-aminoheptanoyl)-1-methyl-2-phenyl-3-pyrazolin-3-one Formula: C17H24N4O2 MolecularWeight: 316.39806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=CC=CC=C2)C(=O)CCCCCCN)N

Isomeric SMILES

CN1C(=C(C(=O)N1C2=CC=CC=C2)C(=O)CCCCCCN)N

InChI

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