1-[[(4-ethanoylphenyl)amino]methyl]-3-methyl-cyclohepta[c]pyrazol-8-one

Systemtic Name: 1-[[(4-ethanoylphenyl)amino]methyl]-3-methyl-cyclohepta[c]pyrazol-8-one Openeye Name: 1-[(4-acetylanilino)methyl]-3-methyl-cyclohepta[c]pyrazol-8-one CAS Name: 1-[(4-acetylanilino)methyl]-3-methyl-8-cyclohepta[c]pyrazolone IUPAC Name: 1-[(4-acetylanilino)methyl]-3-methylcyclohepta[c]pyrazol-8-one Traditional Name: 1-[(4-acetylanilino)methyl]-3-methyl-cyclohepta[c]pyrazol-8-one Formula: C18H17N3O2 MolecularWeight: 307.34648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=CC=CC2=O)CNC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=NN(C2=C1C=CC=CC2=O)CNC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C18H17N3O2/c1-12-16-5-3-4-6-17(23)18(16)21(20-12)11-19-15-9-7-14(8-10-15)13(2)22/h3-10,19H,11H2,1-2H3