3-phenylpropyl 5-[[3-(butanoylamino)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[[3-(butanoylamino)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[3-(butanoylamino)anilino]-5-oxo-pentanoate CAS Name: 5-oxo-5-[3-(1-oxobutylamino)anilino]pentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[3-(butanoylamino)anilino]-5-oxopentanoate Traditional Name: 5-(3-butyramidoanilino)-5-keto-valeric acid 3-phenylpropyl ester Formula: C24H30N2O4 MolecularWeight: 410.506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C24H30N2O4/c1-2-9-22(27)25-20-13-6-14-21(18-20)26-23(28)15-7-16-24(29)30-17-8-12-19-10-4-3-5-11-19/h3-6,10-11,13-14,18H,2,7-9,12,15-17H2,1H3,(H,25,27)(H,26,28)