(E)-4-(3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)pent-3-en-2-one

Systemtic Name: (E)-4-(3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)pent-3-en-2-one Openeye Name: (E)-4-(3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)pent-3-en-2-one CAS Name: (E)-4-(3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)-3-penten-2-one IUPAC Name: (E)-4-(3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl)pent-3-en-2-one Traditional Name: (E)-4-(3-cyclopentyl-7-methoxy-3,3a,4,5-tetrahydrobenz[g]indazol-2-yl)pent-3-en-2-one Formula: C22H23N2O2 MolecularWeight: 347.43022

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)N1C(C2CCC3=C(C2=N1)C=CC(=C3)OC)[C]4[CH][CH][CH][CH]4

Isomeric SMILES

C/C(=C\C(=O)C)/N1C(C2CCC3=C(C2=N1)C=CC(=C3)OC)[C]4[CH][CH][CH][CH]4

InChI

InChI=1S/C22H23N2O2/c1-14(12-15(2)25)24-22(16-6-4-5-7-16)20-10-8-17-13-18(26-3)9-11-19(17)21(20)23-24/h4-7,9,11-13,20,22H,8,10H2,1-3H3/b14-12+