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

Systemtic Name: 1-[(4-methoxyphenyl)amino]-8,8-dimethyl-2-propan-2-yl-6,7-dihydro-5H-phenanthrene-3,4-dione Openeye Name: 2-isopropyl-1-(4-methoxyanilino)-8,8-dimethyl-6,7-dihydro-5H-phenanthrene-3,4-dione CAS Name: 1-(4-methoxyanilino)-8,8-dimethyl-2-propan-2-yl-6,7-dihydro-5H-phenanthrene-3,4-dione IUPAC Name: 1-(4-methoxyanilino)-8,8-dimethyl-2-propan-2-yl-6,7-dihydro-5H-phenanthrene-3,4-dione Traditional Name: 2-isopropyl-8,8-dimethyl-1-(p-anisidino)-6,7-dihydro-5H-phenanthrene-3,4-quinone Formula: C26H29NO3 MolecularWeight: 403.51336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=C(C3=C(C=C2)C(CCC3)(C)C)C(=O)C1=O)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)C1=C(C2=C(C3=C(C=C2)C(CCC3)(C)C)C(=O)C1=O)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H29NO3/c1-15(2)21-23(27-16-8-10-17(30-5)11-9-16)19-12-13-20-18(7-6-14-26(20,3)4)22(19)25(29)24(21)28/h8-13,15,27H,6-7,14H2,1-5H3