3-[6-[3-[(4-dimethylaminophenyl)carbamoyl-methyl-amino]phenyl]pyridin-3-yl]-2-ethoxy-propanoic acid

Systemtic Name: 3-[6-[3-[(4-dimethylaminophenyl)carbamoyl-methyl-amino]phenyl]pyridin-3-yl]-2-ethoxy-propanoic acid Openeye Name: 3-[6-[3-[(4-dimethylaminophenyl)carbamoyl-methyl-amino]phenyl]-3-pyridyl]-2-ethoxy-propanoic acid CAS Name: 3-[6-[3-[[[4-(dimethylamino)anilino]-oxomethyl]-methylamino]phenyl]-3-pyridinyl]-2-ethoxypropanoic acid IUPAC Name: 3-[6-[3-[(4-dimethylaminophenyl)carbamoyl-methylamino]phenyl]pyridin-3-yl]-2-ethoxypropanoic acid Traditional Name: 3-[6-[3-[(4-dimethylaminophenyl)carbamoyl-methyl-amino]phenyl]-3-pyridyl]-2-ethoxy-propionic acid Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CN=C(C=C1)C2=CC(=CC=C2)N(C)C(=O)NC3=CC=C(C=C3)N(C)C)C(=O)O

Isomeric SMILES

CCOC(CC1=CN=C(C=C1)C2=CC(=CC=C2)N(C)C(=O)NC3=CC=C(C=C3)N(C)C)C(=O)O

InChI

InChI=1S/C26H30N4O4/c1-5-34-24(25(31)32)15-18-9-14-23(27-17-18)19-7-6-8-22(16-19)30(4)26(33)28-20-10-12-21(13-11-20)29(2)3/h6-14,16-17,24H,5,15H2,1-4H3,(H,28,33)(H,31,32)