2-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl-phenyl-amino]ethanoic acid hydrate

Systemtic Name: 2-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl-phenyl-amino]ethanoic acid hydrate Openeye Name: 2-[N-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]anilino]acetic acid hydrate CAS Name: 2-(N-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]anilino)acetic acid hydrate IUPAC Name: 2-[N-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]anilino]acetic acid hydrate Traditional Name: 2-[N-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]anilino]acetic acid hydrate Formula: C23H30N2O6 MolecularWeight: 430.4941

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CC(=O)O)C2=CC=CC=C2.O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CC(=O)O)C2=CC=CC=C2.O

InChI

InChI=1S/C23H28N2O5.H2O/c1-3-30-23(29)20(15-14-18-10-6-4-7-11-18)24-17(2)22(28)25(16-21(26)27)19-12-8-5-9-13-19;/h4-13,17,20,24H,3,14-16H2,1-2H3,(H,26,27);1H2