3-[2-(3-phenylazanylpropoxycarbonylamino)ethanoylamino]-3-(4-phenylphenyl)propanoic acid

Systemtic Name: 3-[2-(3-phenylazanylpropoxycarbonylamino)ethanoylamino]-3-(4-phenylphenyl)propanoic acid Openeye Name: 3-[[2-(3-anilinopropoxycarbonylamino)acetyl]amino]-3-(4-phenylphenyl)propanoic acid CAS Name: 3-[[2-[[3-anilinopropoxy(oxo)methyl]amino]-1-oxoethyl]amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: 3-[[2-(3-anilinopropoxycarbonylamino)acetyl]amino]-3-(4-phenylphenyl)propanoic acid Traditional Name: 3-[[2-(3-anilinopropoxycarbonylamino)acetyl]amino]-3-(4-phenylphenyl)propionic acid Formula: C27H29N3O5 MolecularWeight: 475.53626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(CC(=O)O)NC(=O)CNC(=O)OCCCNC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(CC(=O)O)NC(=O)CNC(=O)OCCCNC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O5/c31-25(19-29-27(34)35-17-7-16-28-23-10-5-2-6-11-23)30-24(18-26(32)33)22-14-12-21(13-15-22)20-8-3-1-4-9-20/h1-6,8-15,24,28H,7,16-19H2,(H,29,34)(H,30,31)(H,32,33)