N-[(4S)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]pent-4-enamide

Systemtic Name: N-[(4S)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]pent-4-enamide Openeye Name: N-[(4S)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]pent-4-enamide CAS Name: N-[(4S)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]-4-pentenamide IUPAC Name: N-[(4S)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]pent-4-enamide Traditional Name: N-[(4S)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]pent-4-enamide Formula: C21H27N3O2 MolecularWeight: 353.45798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(C1)N(N=C2)C3=CC=C(C=C3)OC)NC(=O)CCC=C)C

Isomeric SMILES

CC1(C[C@@H](C2=C(C1)N(N=C2)C3=CC=C(C=C3)OC)NC(=O)CCC=C)C

InChI

InChI=1S/C21H27N3O2/c1-5-6-7-20(25)23-18-12-21(2,3)13-19-17(18)14-22-24(19)15-8-10-16(26-4)11-9-15/h5,8-11,14,18H,1,6-7,12-13H2,2-4H3,(H,23,25)/t18-/m0/s1