3-[2-[(3-methylphenyl)carbamoylamino]ethanoyl-phenyl-amino]-3-phenyl-propanoic acid

Systemtic Name: 3-[2-[(3-methylphenyl)carbamoylamino]ethanoyl-phenyl-amino]-3-phenyl-propanoic acid Openeye Name: 3-(N-[2-(m-tolylcarbamoylamino)acetyl]anilino)-3-phenyl-propanoic acid CAS Name: 3-(N-[2-[[(3-methylanilino)-oxomethyl]amino]-1-oxoethyl]anilino)-3-phenylpropanoic acid IUPAC Name: 3-(N-[2-[(3-methylphenyl)carbamoylamino]acetyl]anilino)-3-phenylpropanoic acid Traditional Name: 3-(N-[2-(m-tolylcarbamoylamino)acetyl]anilino)-3-phenyl-propionic acid Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCC(=O)N(C2=CC=CC=C2)C(CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCC(=O)N(C2=CC=CC=C2)C(CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C25H25N3O4/c1-18-9-8-12-20(15-18)27-25(32)26-17-23(29)28(21-13-6-3-7-14-21)22(16-24(30)31)19-10-4-2-5-11-19/h2-15,22H,16-17H2,1H3,(H,30,31)(H2,26,27,32)