5-azanyl-2-[(4-chloranyl-5,6,7,8-tetrahydronaphthalen-2-yl)methyl]-1H-pyrazol-3-one

Systemtic Name: 5-azanyl-2-[(4-chloranyl-5,6,7,8-tetrahydronaphthalen-2-yl)methyl]-1H-pyrazol-3-one Openeye Name: 5-amino-2-[(8-chlorotetralin-6-yl)methyl]-1H-pyrazol-3-one CAS Name: 5-amino-2-[(4-chloro-5,6,7,8-tetrahydronaphthalen-2-yl)methyl]-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[(4-chloro-5,6,7,8-tetrahydronaphthalen-2-yl)methyl]-1H-pyrazol-3-one Traditional Name: 5-amino-2-[(8-chlorotetralin-6-yl)methyl]-3-pyrazolin-3-one Formula: C14H16ClN3O MolecularWeight: 277.74934

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C=C(C=C2C1)CN3C(=O)C=C(N3)N)Cl

Isomeric SMILES

C1CCC2=C(C=C(C=C2C1)CN3C(=O)C=C(N3)N)Cl

InChI

InChI=1S/C14H16ClN3O/c15-12-6-9(5-10-3-1-2-4-11(10)12)8-18-14(19)7-13(16)17-18/h5-7,17H,1-4,8,16H2