3-phenylpropyl 5-[(2-bromophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: 3-phenylpropyl 5-[(2-bromophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: 3-phenylpropyl 5-(2-bromoanilino)-5-oxo-pentanoate CAS Name: 5-(2-bromoanilino)-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-(2-bromoanilino)-5-oxopentanoate Traditional Name: 5-(2-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=CC=C2Br

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=CC=C2Br

InChI

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