2-methyl-1-[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]prop-2-en-1-one

Systemtic Name: 2-methyl-1-[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]prop-2-en-1-one Openeye Name: 1-[(4R,7S)-7-isopropyl-4-methyl-3-phenyl-4,5,6,7-tetrahydroindazol-2-yl]-2-methyl-prop-2-en-1-one CAS Name: 2-methyl-1-[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]-2-propen-1-one IUPAC Name: 2-methyl-1-[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]prop-2-en-1-one Traditional Name: 1-[(4R,7S)-7-isopropyl-4-methyl-3-phenyl-4,5,6,7-tetrahydroindazol-2-yl]-2-methyl-prop-2-en-1-one Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C2=NN(C(=C12)C3=CC=CC=C3)C(=O)C(=C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H](C2=NN(C(=C12)C3=CC=CC=C3)C(=O)C(=C)C)C(C)C

InChI

InChI=1S/C21H26N2O/c1-13(2)17-12-11-15(5)18-19(17)22-23(21(24)14(3)4)20(18)16-9-7-6-8-10-16/h6-10,13,15,17H,3,11-12H2,1-2,4-5H3/t15-,17+/m1/s1