4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide Openeye Name: 4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide CAS Name: 4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxy-N-[2-(1-phenyl-4-pyrazolyl)ethyl]benzamide IUPAC Name: 4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxy-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide Traditional Name: 4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-N-[2-(1-phenylpyrazol-4-yl)ethyl]benzamide Formula: C21H21ClN4O4 MolecularWeight: 428.86884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)NCCC2=CN(N=C2)C3=CC=CC=C3)Cl)OCC(=O)N

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)NCCC2=CN(N=C2)C3=CC=CC=C3)Cl)OCC(=O)N

InChI

InChI=1S/C21H21ClN4O4/c1-29-18-10-15(9-17(22)20(18)30-13-19(23)27)21(28)24-8-7-14-11-25-26(12-14)16-5-3-2-4-6-16/h2-6,9-12H,7-8,13H2,1H3,(H2,23,27)(H,24,28)