[[(Z)-1-[(6-chloranylpyridin-3-yl)methyl-ethyl-amino]prop-1-enyl]-methyl-carbamoyl]oxymethyl benzoate

Systemtic Name: [[(Z)-1-[(6-chloranylpyridin-3-yl)methyl-ethyl-amino]prop-1-enyl]-methyl-carbamoyl]oxymethyl benzoate Openeye Name: [[(Z)-1-[(6-chloro-3-pyridyl)methyl-ethyl-amino]prop-1-enyl]-methyl-carbamoyl]oxymethyl benzoate CAS Name: benzoic acid [[[(Z)-1-[(6-chloro-3-pyridinyl)methyl-ethylamino]prop-1-enyl]-methylamino]-oxomethoxy]methyl ester IUPAC Name: [[(Z)-1-[(6-chloropyridin-3-yl)methyl-ethylamino]prop-1-enyl]-methylcarbamoyl]oxymethyl benzoate Traditional Name: benzoic acid [[(Z)-1-[(6-chloro-3-pyridyl)methyl-ethyl-amino]prop-1-enyl]-methyl-carbamoyl]oxymethyl ester Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CN=C(C=C1)Cl)C(=CC)N(C)C(=O)OCOC(=O)C2=CC=CC=C2

Isomeric SMILES

CCN(CC1=CN=C(C=C1)Cl)/C(=C/C)/N(C)C(=O)OCOC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H24ClN3O4/c1-4-19(25(5-2)14-16-11-12-18(22)23-13-16)24(3)21(27)29-15-28-20(26)17-9-7-6-8-10-17/h4,6-13H,5,14-15H2,1-3H3/b19-4+