diethyl (E)-2-[(2-bromophenyl)amino]-3-butyl-but-2-enedioate

Systemtic Name: diethyl (E)-2-[(2-bromophenyl)amino]-3-butyl-but-2-enedioate Openeye Name: diethyl (E)-2-(2-bromoanilino)-3-butyl-but-2-enedioate CAS Name: (E)-2-(2-bromoanilino)-3-butyl-2-butenedioic acid diethyl ester IUPAC Name: diethyl (E)-2-(2-bromoanilino)-3-butylbut-2-enedioate Traditional Name: (E)-2-(2-bromoanilino)-3-butyl-but-2-enedioic acid diethyl ester Formula: C18H24BrNO4 MolecularWeight: 398.29146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(C(=O)OCC)NC1=CC=CC=C1Br)C(=O)OCC

Isomeric SMILES

CCCC/C(=C(/C(=O)OCC)\NC1=CC=CC=C1Br)/C(=O)OCC

InChI

InChI=1S/C18H24BrNO4/c1-4-7-10-13(17(21)23-5-2)16(18(22)24-6-3)20-15-12-9-8-11-14(15)19/h8-9,11-12,20H,4-7,10H2,1-3H3/b16-13+