2-(phenylmethoxycarbonylamino)-2-[4-[3-(pyridin-4-ylcarbamoylamino)phenyl]phenyl]propanoic acid

Systemtic Name: 2-(phenylmethoxycarbonylamino)-2-[4-[3-(pyridin-4-ylcarbamoylamino)phenyl]phenyl]propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-2-[4-[3-(4-pyridylcarbamoylamino)phenyl]phenyl]propanoic acid CAS Name: 2-[4-[3-[[oxo-(pyridin-4-ylamino)methyl]amino]phenyl]phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 2-(phenylmethoxycarbonylamino)-2-[4-[3-(pyridin-4-ylcarbamoylamino)phenyl]phenyl]propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-2-[4-[3-(4-pyridylcarbamoylamino)phenyl]phenyl]propionic acid Formula: C29H26N4O5 MolecularWeight: 510.54054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)NC3=CC=NC=C3)(C(=O)O)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)NC3=CC=NC=C3)(C(=O)O)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H26N4O5/c1-29(26(34)35,33-28(37)38-19-20-6-3-2-4-7-20)23-12-10-21(11-13-23)22-8-5-9-25(18-22)32-27(36)31-24-14-16-30-17-15-24/h2-18H,19H2,1H3,(H,33,37)(H,34,35)(H2,30,31,32,36)