methyl 5-[[[(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]amino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[[(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]amino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenyl-ethyl]amino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]amino]methyl]-2-methoxybenzoate Traditional Name: 5-[[[(1S)-2-(ethylcarbamoylamino)-2-keto-1-phenyl-ethyl]amino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C1=CC=CC=C1)NCC2=CC(=C(C=C2)OC)C(=O)OC

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C1=CC=CC=C1)NCC2=CC(=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C21H25N3O5/c1-4-22-21(27)24-19(25)18(15-8-6-5-7-9-15)23-13-14-10-11-17(28-2)16(12-14)20(26)29-3/h5-12,18,23H,4,13H2,1-3H3,(H2,22,24,25,27)/t18-/m0/s1