(phenylmethyl) 2-[(4-isocyanophenyl)methyl-methyl-amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(4-isocyanophenyl)methyl-methyl-amino]ethanoate Openeye Name: benzyl 2-[(4-isocyanophenyl)methyl-methyl-amino]acetate CAS Name: 2-[(4-isocyanophenyl)methyl-methylamino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-isocyanophenyl)methyl-methylamino]acetate Traditional Name: 2-[(4-isocyanobenzyl)-methyl-amino]acetic acid benzyl ester Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)[N+]#[C-])CC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CN(CC1=CC=C(C=C1)[N+]#[C-])CC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O2/c1-19-17-10-8-15(9-11-17)12-20(2)13-18(21)22-14-16-6-4-3-5-7-16/h3-11H,12-14H2,2H3