2-(phenylmethoxycarbonylamino)-2-[4-[3-(2-pyrrolidin-1-ylethanoylamino)phenyl]phenyl]propanoic acid

Systemtic Name: 2-(phenylmethoxycarbonylamino)-2-[4-[3-(2-pyrrolidin-1-ylethanoylamino)phenyl]phenyl]propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-2-[4-[3-[(2-pyrrolidin-1-ylacetyl)amino]phenyl]phenyl]propanoic acid CAS Name: 2-[4-[3-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]phenyl]phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 2-(phenylmethoxycarbonylamino)-2-[4-[3-[(2-pyrrolidin-1-ylacetyl)amino]phenyl]phenyl]propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-2-[4-[3-[(2-pyrrolidinoacetyl)amino]phenyl]phenyl]propionic acid Formula: C29H31N3O5 MolecularWeight: 501.57354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)CN3CCCC3)(C(=O)O)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)CN3CCCC3)(C(=O)O)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O5/c1-29(27(34)35,31-28(36)37-20-21-8-3-2-4-9-21)24-14-12-22(13-15-24)23-10-7-11-25(18-23)30-26(33)19-32-16-5-6-17-32/h2-4,7-15,18H,5-6,16-17,19-20H2,1H3,(H,30,33)(H,31,36)(H,34,35)