N-[[4-[3-[4-(aminomethyl)phenoxy]propoxy]phenyl]methyl]-4-isocyano-benzamide

Systemtic Name: N-[[4-[3-[4-(aminomethyl)phenoxy]propoxy]phenyl]methyl]-4-isocyano-benzamide Openeye Name: N-[[4-[3-[4-(aminomethyl)phenoxy]propoxy]phenyl]methyl]-4-isocyano-benzamide CAS Name: N-[[4-[3-[4-(aminomethyl)phenoxy]propoxy]phenyl]methyl]-4-isocyanobenzamide IUPAC Name: N-[[4-[3-[4-(aminomethyl)phenoxy]propoxy]phenyl]methyl]-4-isocyanobenzamide Traditional Name: N-[4-[3-[4-(aminomethyl)phenoxy]propoxy]benzyl]-4-isocyano-benzamide Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)OCCCOC3=CC=C(C=C3)CN

Isomeric SMILES

[C-]#[N+]C1=CC=C(C=C1)C(=O)NCC2=CC=C(C=C2)OCCCOC3=CC=C(C=C3)CN

InChI

InChI=1S/C25H25N3O3/c1-27-22-9-7-21(8-10-22)25(29)28-18-20-5-13-24(14-6-20)31-16-2-15-30-23-11-3-19(17-26)4-12-23/h3-14H,2,15-18,26H2,(H,28,29)