(phenylmethyl) 3-[(1-chloroethyloxycarbonylamino)methyl]-5-methyl-hexanoate

Systemtic Name: (phenylmethyl) 3-[(1-chloroethyloxycarbonylamino)methyl]-5-methyl-hexanoate Openeye Name: benzyl 3-[(1-chloroethoxycarbonylamino)methyl]-5-methyl-hexanoate CAS Name: 3-[[[1-chloroethoxy(oxo)methyl]amino]methyl]-5-methylhexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[(1-chloroethoxycarbonylamino)methyl]-5-methylhexanoate Traditional Name: 3-[(1-chloroethoxycarbonylamino)methyl]-5-methyl-hexanoic acid benzyl ester Formula: C18H26ClNO4 MolecularWeight: 355.85634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)OCC1=CC=CC=C1)CNC(=O)OC(C)Cl

Isomeric SMILES

CC(C)CC(CC(=O)OCC1=CC=CC=C1)CNC(=O)OC(C)Cl

InChI

InChI=1S/C18H26ClNO4/c1-13(2)9-16(11-20-18(22)24-14(3)19)10-17(21)23-12-15-7-5-4-6-8-15/h4-8,13-14,16H,9-12H2,1-3H3,(H,20,22)