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5-(4-tert-butylphenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one
5-(4-tert-butylphenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one
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Descriptors Computed from Structure
Canonical SMILES:
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(C=C5)C(C)(C)C)C(=O)C1)C
Isomeric SMILES
CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(C=C5)C(C)(C)C)C(=O)C1)C
InChI
InChI=1S/C29H31NO/c1-28(2,3)20-13-10-19(11-14-20)27-26-22(16-29(4,5)17-24(26)31)25-21-9-7-6-8-18(21)12-15-23(25)30-27/h6-15,27,30H,16-17H2,1-5H3
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