8,8-dimethyl-1-[(4-methylphenyl)amino]-2-propan-2-yl-6,7-dihydro-5H-phenanthrene-3,4-dione

Systemtic Name: 8,8-dimethyl-1-[(4-methylphenyl)amino]-2-propan-2-yl-6,7-dihydro-5H-phenanthrene-3,4-dione Openeye Name: 2-isopropyl-8,8-dimethyl-1-(4-methylanilino)-6,7-dihydro-5H-phenanthrene-3,4-dione CAS Name: 8,8-dimethyl-1-(4-methylanilino)-2-propan-2-yl-6,7-dihydro-5H-phenanthrene-3,4-dione IUPAC Name: 8,8-dimethyl-1-(4-methylanilino)-2-propan-2-yl-6,7-dihydro-5H-phenanthrene-3,4-dione Traditional Name: 2-isopropyl-8,8-dimethyl-1-(p-toluidino)-6,7-dihydro-5H-phenanthrene-3,4-quinone Formula: C26H29NO2 MolecularWeight: 387.51396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=O)C(=O)C3=C2C=CC4=C3CCCC4(C)C)C(C)C

InChI

InChI=1S/C26H29NO2/c1-15(2)21-23(27-17-10-8-16(3)9-11-17)19-12-13-20-18(7-6-14-26(20,4)5)22(19)25(29)24(21)28/h8-13,15,27H,6-7,14H2,1-5H3