calcium (Z)-4-[2-(diphenylmethylidene)hydrazinyl]-4-oxidanylidene-but-2-enoate

Systemtic Name: calcium (Z)-4-[2-(diphenylmethylidene)hydrazinyl]-4-oxidanylidene-but-2-enoate Openeye Name: calcium (Z)-4-(2-benzhydrylidenehydrazino)-4-oxo-but-2-enoate CAS Name: calcium (Z)-4-[2-(diphenylmethylene)hydrazinyl]-4-oxo-2-butenoate IUPAC Name: calcium (Z)-4-(2-benzhydrylidenehydrazinyl)-4-oxobut-2-enoate Traditional Name: calcium (Z)-4-(N'-benzhydrylidenehydrazino)-4-keto-but-2-enoate Formula: C34H26CaN4O6 MolecularWeight: 626.67144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NNC(=O)C=CC(=O)[O-])C2=CC=CC=C2.C1=CC=C(C=C1)C(=NNC(=O)C=CC(=O)[O-])C2=CC=CC=C2.[Ca+2]

Isomeric SMILES

C1=CC=C(C=C1)C(=NNC(=O)/C=C\C(=O)[O-])C2=CC=CC=C2.C1=CC=C(C=C1)C(=NNC(=O)/C=C\C(=O)[O-])C2=CC=CC=C2.[Ca+2]

InChI

InChI=1S/2C17H14N2O3.Ca/c2*20-15(11-12-16(21)22)18-19-17(13-7-3-1-4-8-13)14-9-5-2-6-10-14;/h2*1-12H,(H,18,20)(H,21,22);/q;;+2/p-2/b2*12-11-;