tert-butyl 2-[[3-[(3-methylphenyl)carbamoylamino]-3-phenyl-propanoyl]-phenyl-amino]ethanoate

Systemtic Name: tert-butyl 2-[[3-[(3-methylphenyl)carbamoylamino]-3-phenyl-propanoyl]-phenyl-amino]ethanoate Openeye Name: tert-butyl 2-(N-[3-(m-tolylcarbamoylamino)-3-phenyl-propanoyl]anilino)acetate CAS Name: 2-(N-[3-[[(3-methylanilino)-oxomethyl]amino]-1-oxo-3-phenylpropyl]anilino)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(N-[3-[(3-methylphenyl)carbamoylamino]-3-phenylpropanoyl]anilino)acetate Traditional Name: 2-(N-[3-(m-tolylcarbamoylamino)-3-phenyl-propanoyl]anilino)acetic acid tert-butyl ester Formula: C29H33N3O4 MolecularWeight: 487.59002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H33N3O4/c1-21-12-11-15-23(18-21)30-28(35)31-25(22-13-7-5-8-14-22)19-26(33)32(24-16-9-6-10-17-24)20-27(34)36-29(2,3)4/h5-18,25H,19-20H2,1-4H3,(H2,30,31,35)