(E)-4-(3-cyclopentyl-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)pent-3-en-2-one

Systemtic Name: (E)-4-(3-cyclopentyl-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)pent-3-en-2-one Openeye Name: (E)-4-(3-cyclopentyl-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)pent-3-en-2-one CAS Name: (E)-4-(3-cyclopentyl-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)-3-penten-2-one IUPAC Name: (E)-4-(3-cyclopentyl-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)pent-3-en-2-one Traditional Name: (E)-4-(3-cyclopentyl-3,3a,4,5-tetrahydrobenz[g]indazol-2-yl)pent-3-en-2-one Formula: C21H21N2O MolecularWeight: 317.40424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)N1C(C2CCC3=CC=CC=C3C2=N1)[C]4[CH][CH][CH][CH]4

Isomeric SMILES

C/C(=C\C(=O)C)/N1C(C2CCC3=CC=CC=C3C2=N1)[C]4[CH][CH][CH][CH]4

InChI

InChI=1S/C21H21N2O/c1-14(13-15(2)24)23-21(17-8-3-4-9-17)19-12-11-16-7-5-6-10-18(16)20(19)22-23/h3-10,13,19,21H,11-12H2,1-2H3/b14-13+