(phenylmethyl) 2-azanyl-7-oxidanylidene-7-[3-(1H-pyrazol-4-yl)propylamino]heptanoate

Systemtic Name: (phenylmethyl) 2-azanyl-7-oxidanylidene-7-[3-(1H-pyrazol-4-yl)propylamino]heptanoate Openeye Name: benzyl 2-amino-7-oxo-7-[3-(1H-pyrazol-4-yl)propylamino]heptanoate CAS Name: 2-amino-7-oxo-7-[3-(1H-pyrazol-4-yl)propylamino]heptanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-7-oxo-7-[3-(1H-pyrazol-4-yl)propylamino]heptanoate Traditional Name: 2-amino-7-keto-7-[3-(1H-pyrazol-4-yl)propylamino]enanthic acid benzyl ester Formula: C20H28N4O3 MolecularWeight: 372.46132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CCCCC(=O)NCCCC2=CNN=C2)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CCCCC(=O)NCCCC2=CNN=C2)N

InChI

InChI=1S/C20H28N4O3/c21-18(20(26)27-15-16-7-2-1-3-8-16)10-4-5-11-19(25)22-12-6-9-17-13-23-24-14-17/h1-3,7-8,13-14,18H,4-6,9-12,15,21H2,(H,22,25)(H,23,24)