7-(2-dimethylaminoethylamino)-2-[(4-phenylmethoxyphenoxy)methyl]quinoline-5,8-dione

Systemtic Name: 7-(2-dimethylaminoethylamino)-2-[(4-phenylmethoxyphenoxy)methyl]quinoline-5,8-dione Openeye Name: 2-[(4-benzyloxyphenoxy)methyl]-7-(2-dimethylaminoethylamino)quinoline-5,8-dione CAS Name: 7-(2-dimethylaminoethylamino)-2-[(4-phenylmethoxyphenoxy)methyl]quinoline-5,8-dione IUPAC Name: 7-(2-dimethylaminoethylamino)-2-[(4-phenylmethoxyphenoxy)methyl]quinoline-5,8-dione Traditional Name: 2-[(4-benzoxyphenoxy)methyl]-7-(2-dimethylaminoethylamino)quinoline-5,8-quinone Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=CC(=O)C2=C(C1=O)N=C(C=C2)COC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CN(C)CCNC1=CC(=O)C2=C(C1=O)N=C(C=C2)COC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O4/c1-30(2)15-14-28-24-16-25(31)23-13-8-20(29-26(23)27(24)32)18-34-22-11-9-21(10-12-22)33-17-19-6-4-3-5-7-19/h3-13,16,28H,14-15,17-18H2,1-2H3