2-[(4-bromophenyl)carbonyl-cyclohex-2-en-1-yl-amino]butanedioate

Systemtic Name: 2-[(4-bromophenyl)carbonyl-cyclohex-2-en-1-yl-amino]butanedioate Openeye Name: 2-[(4-bromobenzoyl)-cyclohex-2-en-1-yl-amino]butanedioate CAS Name: 2-[[(4-bromophenyl)-oxomethyl]-(1-cyclohex-2-enyl)amino]butanedioate IUPAC Name: 2-[(4-bromobenzoyl)-cyclohex-2-en-1-ylamino]butanedioate Traditional Name: 2-[(4-bromobenzoyl)-cyclohex-2-en-1-yl-amino]succinate Formula: C17H16BrNO5-2 MolecularWeight: 394.21664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=CC(C1)N(C(CC(=O)[O-])C(=O)[O-])C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1CC=CC(C1)N(C(CC(=O)[O-])C(=O)[O-])C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H18BrNO5/c18-12-8-6-11(7-9-12)16(22)19(13-4-2-1-3-5-13)14(17(23)24)10-15(20)21/h2,4,6-9,13-14H,1,3,5,10H2,(H,20,21)(H,23,24)/p-2