3-phenylpropyl 5-[[4-(butanoylamino)phenyl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[[4-(butanoylamino)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[4-(butanoylamino)anilino]-5-oxo-pentanoate CAS Name: 5-oxo-5-[4-(1-oxobutylamino)anilino]pentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[4-(butanoylamino)anilino]-5-oxopentanoate Traditional Name: 5-(4-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=C(C=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

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

InChI

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