3-phenylpropyl 4-[[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 3-phenylpropyl 4-[[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[4-[2-(methylamino)-2-oxo-ethyl]anilino]-4-oxo-butanoate CAS Name: 4-[4-[2-(methylamino)-2-oxoethyl]anilino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[4-[2-(methylamino)-2-oxoethyl]anilino]-4-oxobutanoate Traditional Name: 4-keto-4-[4-[2-keto-2-(methylamino)ethyl]anilino]butyric acid 3-phenylpropyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC1=CC=C(C=C1)NC(=O)CCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CNC(=O)CC1=CC=C(C=C1)NC(=O)CCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O4/c1-23-21(26)16-18-9-11-19(12-10-18)24-20(25)13-14-22(27)28-15-5-8-17-6-3-2-4-7-17/h2-4,6-7,9-12H,5,8,13-16H2,1H3,(H,23,26)(H,24,25)