2-[(3-bromophenyl)methyl-(4-chloranyl-2-methyl-phenyl)carbonyl-amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(3-bromophenyl)methyl-(4-chloranyl-2-methyl-phenyl)carbonyl-amino]-3-phenyl-propanoic acid Openeye Name: 2-[(3-bromophenyl)methyl-(4-chloro-2-methyl-benzoyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[(3-bromophenyl)methyl-[(4-chloro-2-methylphenyl)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[(3-bromophenyl)methyl-(4-chloro-2-methylbenzoyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[(3-bromobenzyl)-(4-chloro-2-methyl-benzoyl)amino]-3-phenyl-propionic acid Formula: C24H21BrClNO3 MolecularWeight: 486.78544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)C(=O)N(CC2=CC(=CC=C2)Br)C(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)C(=O)N(CC2=CC(=CC=C2)Br)C(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C24H21BrClNO3/c1-16-12-20(26)10-11-21(16)23(28)27(15-18-8-5-9-19(25)13-18)22(24(29)30)14-17-6-3-2-4-7-17/h2-13,22H,14-15H2,1H3,(H,29,30)