2-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(cyclopropylmethyl)amino]ethanoic acid

Systemtic Name: 2-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-(cyclopropylmethyl)amino]acetic acid CAS Name: 2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-(cyclopropylmethyl)amino]acetic acid IUPAC Name: 2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-(cyclopropylmethyl)amino]acetic acid Traditional Name: 2-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-(cyclopropylmethyl)amino]acetic acid Formula: C15H19BrN2O3 MolecularWeight: 355.22696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(CC2CC2)CC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(CC2CC2)CC(=O)O

InChI

InChI=1S/C15H19BrN2O3/c1-10-6-12(16)4-5-13(10)17-14(19)8-18(9-15(20)21)7-11-2-3-11/h4-6,11H,2-3,7-9H2,1H3,(H,17,19)(H,20,21)