1,3-bis[4-[(2-isocyanatophenyl)methyl]phenyl]urea

Systemtic Name: 1,3-bis[4-[(2-isocyanatophenyl)methyl]phenyl]urea Openeye Name: 1,3-bis[4-[(2-isocyanatophenyl)methyl]phenyl]urea CAS Name: 1,3-bis[4-[(2-isocyanatophenyl)methyl]phenyl]urea IUPAC Name: 1,3-bis[4-[(2-isocyanatophenyl)methyl]phenyl]urea Traditional Name: 1,3-bis[4-(2-isocyanatobenzyl)phenyl]urea Formula: C29H22N4O3 MolecularWeight: 474.50998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)CC4=CC=CC=C4N=C=O)N=C=O

Isomeric SMILES

C1=CC=C(C(=C1)CC2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)CC4=CC=CC=C4N=C=O)N=C=O

InChI

InChI=1S/C29H22N4O3/c34-19-30-27-7-3-1-5-23(27)17-21-9-13-25(14-10-21)32-29(36)33-26-15-11-22(12-16-26)18-24-6-2-4-8-28(24)31-20-35/h1-16H,17-18H2,(H2,32,33,36)