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

Systemtic Name: 3-phenylpropyl 5-[(4-bromophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-(4-bromoanilino)-5-oxo-pentanoate CAS Name: 5-(4-bromoanilino)-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-(4-bromoanilino)-5-oxopentanoate Traditional Name: 5-(4-bromoanilino)-5-keto-valeric acid 3-phenylpropyl ester Formula: C20H22BrNO3 MolecularWeight: 404.29758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C20H22BrNO3/c21-17-11-13-18(14-12-17)22-19(23)9-4-10-20(24)25-15-5-8-16-6-2-1-3-7-16/h1-3,6-7,11-14H,4-5,8-10,15H2,(H,22,23)