(4E)-1-[3-(dimethylamino)propyl]-5-(3-ethoxy-4-phenylmethoxy-phenyl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-1-[3-(dimethylamino)propyl]-5-(3-ethoxy-4-phenylmethoxy-phenyl)-4-[oxidanyl(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-5-(4-benzyloxy-3-ethoxy-phenyl)-1-[3-(dimethylamino)propyl]-4-[hydroxy(4-pyridyl)methylene]pyrrolidine-2,3-dione CAS Name: (4E)-1-[3-(dimethylamino)propyl]-5-(3-ethoxy-4-phenylmethoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione IUPAC Name: (4E)-1-[3-(dimethylamino)propyl]-5-(3-ethoxy-4-phenylmethoxyphenyl)-4-[hydroxy(pyridin-4-yl)methylidene]pyrrolidine-2,3-dione Traditional Name: (4E)-5-(4-benzoxy-3-ethoxy-phenyl)-1-[3-(dimethylamino)propyl]-4-[hydroxy(4-pyridyl)methylene]pyrrolidine-2,3-quinone Formula: C30H33N3O5 MolecularWeight: 515.60012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(C3=CC=NC=C3)O)C(=O)C(=O)N2CCCN(C)C)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2/C(=C(/C3=CC=NC=C3)\O)/C(=O)C(=O)N2CCCN(C)C)OCC4=CC=CC=C4

InChI

InChI=1S/C30H33N3O5/c1-4-37-25-19-23(11-12-24(25)38-20-21-9-6-5-7-10-21)27-26(28(34)22-13-15-31-16-14-22)29(35)30(36)33(27)18-8-17-32(2)3/h5-7,9-16,19,27,34H,4,8,17-18,20H2,1-3H3/b28-26+