2,2-bis(7-isocyanatoheptyl)-3-methylidene-butanedioic acid

Systemtic Name: 2,2-bis(7-isocyanatoheptyl)-3-methylidene-butanedioic acid Openeye Name: 2,2-bis(7-isocyanatoheptyl)-3-methylene-butanedioic acid CAS Name: 2,2-bis(7-isocyanatoheptyl)-3-methylenebutanedioic acid IUPAC Name: 2,2-bis(7-isocyanatoheptyl)-3-methylidenebutanedioic acid Traditional Name: 2,2-bis(7-isocyanatoheptyl)-3-methylene-succinic acid Formula: C21H32N2O6 MolecularWeight: 408.48858

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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)