4-[3-azanyl-5-(4-ethylphenyl)-1,2-dihydroindazol-6-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[3-azanyl-5-(4-ethylphenyl)-1,2-dihydroindazol-6-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[3-amino-5-(4-ethylphenyl)-1,2-dihydroindazol-6-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[3-amino-5-(4-ethylphenyl)-1,2-dihydroindazol-6-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[3-amino-5-(4-ethylphenyl)-1,2-dihydroindazol-6-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[3-amino-5-(4-ethylphenyl)-1,2-dihydroindazol-6-ylidene]cyclohexa-2,5-dien-1-one Formula: C21H19N3O MolecularWeight: 329.39506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC3=C(NNC3=CC2=C4C=CC(=O)C=C4)N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC3=C(NNC3=CC2=C4C=CC(=O)C=C4)N

InChI

InChI=1S/C21H19N3O/c1-2-13-3-5-14(6-4-13)17-11-19-20(23-24-21(19)22)12-18(17)15-7-9-16(25)10-8-15/h3-12,23-24H,2,22H2,1H3