[2-[[4-(diethylamino)phenyl]amino]-2-oxidanylidene-ethyl] (3S)-3-benzamido-3-phenyl-propanoate

Systemtic Name: [2-[[4-(diethylamino)phenyl]amino]-2-oxidanylidene-ethyl] (3S)-3-benzamido-3-phenyl-propanoate Openeye Name: [2-[4-(diethylamino)anilino]-2-oxo-ethyl] (3S)-3-benzamido-3-phenyl-propanoate CAS Name: (3S)-3-benzamido-3-phenylpropanoic acid [2-[4-(diethylamino)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(diethylamino)anilino]-2-oxoethyl] (3S)-3-benzamido-3-phenylpropanoate Traditional Name: (3S)-3-benzamido-3-phenyl-propionic acid [2-[4-(diethylamino)anilino]-2-keto-ethyl] ester Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)COC(=O)CC(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)COC(=O)C[C@@H](C2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H31N3O4/c1-3-31(4-2)24-17-15-23(16-18-24)29-26(32)20-35-27(33)19-25(21-11-7-5-8-12-21)30-28(34)22-13-9-6-10-14-22/h5-18,25H,3-4,19-20H2,1-2H3,(H,29,32)(H,30,34)/t25-/m0/s1