ethyl 2-[[1-oxidanyl-4-oxidanylidene-4-[(phenylmethyl)amino]butan-2-yl]-phenyl-amino]ethanoate

Systemtic Name: ethyl 2-[[1-oxidanyl-4-oxidanylidene-4-[(phenylmethyl)amino]butan-2-yl]-phenyl-amino]ethanoate Openeye Name: ethyl 2-(N-[3-(benzylamino)-1-(hydroxymethyl)-3-oxo-propyl]anilino)acetate CAS Name: 2-(N-[1-hydroxy-4-oxo-4-[(phenylmethyl)amino]butan-2-yl]anilino)acetic acid ethyl ester IUPAC Name: ethyl 2-(N-[4-(benzylamino)-1-hydroxy-4-oxobutan-2-yl]anilino)acetate Traditional Name: 2-(N-[3-(benzylamino)-3-keto-1-methylol-propyl]anilino)acetic acid ethyl ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=CC=C1)C(CC(=O)NCC2=CC=CC=C2)CO

Isomeric SMILES

CCOC(=O)CN(C1=CC=CC=C1)C(CC(=O)NCC2=CC=CC=C2)CO

InChI

InChI=1S/C21H26N2O4/c1-2-27-21(26)15-23(18-11-7-4-8-12-18)19(16-24)13-20(25)22-14-17-9-5-3-6-10-17/h3-12,19,24H,2,13-16H2,1H3,(H,22,25)