ethyl 3-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]propanoate

Systemtic Name: ethyl 3-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]propanoate Openeye Name: ethyl 3-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]propanoate CAS Name: 3-[[[[1-[(4-chlorophenyl)methyl]-2-pyrrolyl]methylamino]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]propanoate Traditional Name: 3-[[1-(4-chlorobenzyl)pyrrol-2-yl]methylcarbamoylamino]propionic acid ethyl ester Formula: C18H22ClN3O3 MolecularWeight: 363.83858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)NCC1=CC=CN1CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)CCNC(=O)NCC1=CC=CN1CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H22ClN3O3/c1-2-25-17(23)9-10-20-18(24)21-12-16-4-3-11-22(16)13-14-5-7-15(19)8-6-14/h3-8,11H,2,9-10,12-13H2,1H3,(H2,20,21,24)