2,2-bis(7-isocyanatoheptyl)-3-methylidene-butanedioate

Systemtic Name: 2,2-bis(7-isocyanatoheptyl)-3-methylidene-butanedioate Openeye Name: 2,2-bis(7-isocyanatoheptyl)-3-methylene-butanedioate CAS Name: 2,2-bis(7-isocyanatoheptyl)-3-methylenebutanedioate IUPAC Name: 2,2-bis(7-isocyanatoheptyl)-3-methylidenebutanedioate Traditional Name: 2,2-bis(7-isocyanatoheptyl)-3-methylene-succinate Formula: C21H30N2O6-2 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)[O-])C(CCCCCCCN=C=O)(CCCCCCCN=C=O)C(=O)[O-]

Isomeric SMILES

C=C(C(=O)[O-])C(CCCCCCCN=C=O)(CCCCCCCN=C=O)C(=O)[O-]

InChI

InChI=1S/C21H32N2O6/c1-18(19(26)27)21(20(28)29,12-8-4-2-6-10-14-22-16-24)13-9-5-3-7-11-15-23-17-25/h1-15H2,(H,26,27)(H,28,29)/p-2