3-[2,3-dihydro-1H-inden-1-yl-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]amino]propanoic acid

Systemtic Name: 3-[2,3-dihydro-1H-inden-1-yl-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]amino]propanoic acid Openeye Name: 3-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl-indan-1-yl-amino]propanoic acid CAS Name: 3-[2,3-dihydro-1H-inden-1-yl-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]amino]propanoic acid IUPAC Name: 3-[2,3-dihydro-1H-inden-1-yl-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]amino]propanoic acid Traditional Name: 3-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl-indan-1-yl-amino]propionic acid Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CCC(=O)O)C2CCC3=CC=CC=C23

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CCC(=O)O)C2CCC3=CC=CC=C23

InChI

InChI=1S/C27H34N2O5/c1-3-34-27(33)23(15-13-20-9-5-4-6-10-20)28-19(2)26(32)29(18-17-25(30)31)24-16-14-21-11-7-8-12-22(21)24/h4-12,19,23-24,28H,3,13-18H2,1-2H3,(H,30,31)