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

Systemtic Name: 3-phenylpropyl 5-[[3-(dipropylcarbamoyl)phenyl]amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-[3-(dipropylcarbamoyl)anilino]-5-oxo-pentanoate CAS Name: 5-[3-[(dipropylamino)-oxomethyl]anilino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-[3-(dipropylcarbamoyl)anilino]-5-oxopentanoate Traditional Name: 5-[3-(dipropylcarbamoyl)anilino]-5-keto-valeric acid 3-phenylpropyl ester Formula: C27H36N2O4 MolecularWeight: 452.58574

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC=C1)NC(=O)CCCC(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C27H36N2O4/c1-3-18-29(19-4-2)27(32)23-14-8-15-24(21-23)28-25(30)16-9-17-26(31)33-20-10-13-22-11-6-5-7-12-22/h5-8,11-12,14-15,21H,3-4,9-10,13,16-20H2,1-2H3,(H,28,30)