5-[2-[3-(1-azanylethylideneamino)phenyl]carbonylhydrazinyl]-3-(4-bromophenyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[2-[3-(1-azanylethylideneamino)phenyl]carbonylhydrazinyl]-3-(4-bromophenyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-[3-(1-aminoethylideneamino)benzoyl]hydrazino]-3-(4-bromophenyl)-5-oxo-pentanoic acid CAS Name: 5-[[[3-(1-aminoethylideneamino)phenyl]-oxomethyl]hydrazo]-3-(4-bromophenyl)-5-oxopentanoic acid IUPAC Name: 5-[2-[3-(1-aminoethylideneamino)benzoyl]hydrazinyl]-3-(4-bromophenyl)-5-oxopentanoic acid Traditional Name: 5-[N'-[3-(1-aminoethylideneamino)benzoyl]hydrazino]-3-(4-bromophenyl)-5-keto-valeric acid Formula: C20H21BrN4O4 MolecularWeight: 461.30914

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=CC=CC(=C1)C(=O)NNC(=O)CC(CC(=O)O)C2=CC=C(C=C2)Br)N

Isomeric SMILES

CC(=NC1=CC=CC(=C1)C(=O)NNC(=O)CC(CC(=O)O)C2=CC=C(C=C2)Br)N

InChI

InChI=1S/C20H21BrN4O4/c1-12(22)23-17-4-2-3-14(9-17)20(29)25-24-18(26)10-15(11-19(27)28)13-5-7-16(21)8-6-13/h2-9,15H,10-11H2,1H3,(H2,22,23)(H,24,26)(H,25,29)(H,27,28)