[3-[[[2,5-bis(bromanyl)phenyl]carbonyl-propan-2-yl-amino]-methyl-carbamoyl]phenyl] propanoate

Systemtic Name: [3-[[[2,5-bis(bromanyl)phenyl]carbonyl-propan-2-yl-amino]-methyl-carbamoyl]phenyl] propanoate Openeye Name: [3-[[(2,5-dibromobenzoyl)-isopropyl-amino]-methyl-carbamoyl]phenyl] propanoate CAS Name: propanoic acid [3-[[[[(2,5-dibromophenyl)-oxomethyl]-propan-2-ylamino]-methylamino]-oxomethyl]phenyl] ester IUPAC Name: [3-[[(2,5-dibromobenzoyl)-propan-2-ylamino]-methylcarbamoyl]phenyl] propanoate Traditional Name: propionic acid [3-[[(2,5-dibromobenzoyl)-isopropyl-amino]-methyl-carbamoyl]phenyl] ester Formula: C21H22Br2N2O4 MolecularWeight: 526.21838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=CC(=C1)C(=O)N(C)N(C(C)C)C(=O)C2=C(C=CC(=C2)Br)Br

Isomeric SMILES

CCC(=O)OC1=CC=CC(=C1)C(=O)N(C)N(C(C)C)C(=O)C2=C(C=CC(=C2)Br)Br

InChI

InChI=1S/C21H22Br2N2O4/c1-5-19(26)29-16-8-6-7-14(11-16)20(27)24(4)25(13(2)3)21(28)17-12-15(22)9-10-18(17)23/h6-13H,5H2,1-4H3