bis(phenylmethyl)tin; (E)-4-[(4-bromophenyl)amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: bis(phenylmethyl)tin; (E)-4-[(4-bromophenyl)amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(4-bromoanilino)-4-oxo-but-2-enoic acid; dibenzyltin CAS Name: bis(phenylmethyl)tin; (E)-4-(4-bromoanilino)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(4-bromoanilino)-4-oxobut-2-enoic acid; dibenzyltin Traditional Name: (E)-4-(4-bromoanilino)-4-keto-but-2-enoic acid; dibenzyltin Formula: C34H30Br2N2O6Sn MolecularWeight: 841.1298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[Sn]CC2=CC=CC=C2.C1=CC(=CC=C1NC(=O)C=CC(=O)O)Br.C1=CC(=CC=C1NC(=O)C=CC(=O)O)Br

Isomeric SMILES

C1=CC=C(C=C1)C[Sn]CC2=CC=CC=C2.C1=CC(=CC=C1NC(=O)/C=C/C(=O)O)Br.C1=CC(=CC=C1NC(=O)/C=C/C(=O)O)Br

InChI

InChI=1S/2C10H8BrNO3.2C7H7.Sn/c2*11-7-1-3-8(4-2-7)12-9(13)5-6-10(14)15;2*1-7-5-3-2-4-6-7;/h2*1-6H,(H,12,13)(H,14,15);2*2-6H,1H2;/b2*6-5+;;;