1-azanyl-8,8-dimethyl-2-(1-oxidanylpropyl)-6,7-dihydro-5H-phenanthrene-3,4-dione

Systemtic Name: 1-azanyl-8,8-dimethyl-2-(1-oxidanylpropyl)-6,7-dihydro-5H-phenanthrene-3,4-dione Openeye Name: 1-amino-2-(1-hydroxypropyl)-8,8-dimethyl-6,7-dihydro-5H-phenanthrene-3,4-dione CAS Name: 1-amino-2-(1-hydroxypropyl)-8,8-dimethyl-6,7-dihydro-5H-phenanthrene-3,4-dione IUPAC Name: 1-amino-2-(1-hydroxypropyl)-8,8-dimethyl-6,7-dihydro-5H-phenanthrene-3,4-dione Traditional Name: 1-amino-2-(1-hydroxypropyl)-8,8-dimethyl-6,7-dihydro-5H-phenanthrene-3,4-quinone Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C2=C(C3=C(C=C2)C(CCC3)(C)C)C(=O)C1=O)N)O

Isomeric SMILES

CCC(C1=C(C2=C(C3=C(C=C2)C(CCC3)(C)C)C(=O)C1=O)N)O

InChI

InChI=1S/C19H23NO3/c1-4-13(21)15-16(20)11-7-8-12-10(6-5-9-19(12,2)3)14(11)17(22)18(15)23/h7-8,13,21H,4-6,9,20H2,1-3H3