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methyl 2-[3-(3H-benzo[e]indazol-7-yl)propanoylamino]benzoate

methyl 2-[3-(3H-benzo[e]indazol-7-yl)propanoylamino]benzoate

Systemtic Name:methyl 2-[3-(3H-benzo[e]indazol-7-yl)propanoylamino]benzoate
Openeye Name:methyl 2-[3-(3H-benzo[e]indazol-7-yl)propanoylamino]benzoate
CAS Name:2-[[3-(3H-benzo[e]indazol-7-yl)-1-oxopropyl]amino]benzoic acid methyl ester
IUPAC Name:methyl 2-[3-(3H-benzo[e]indazol-7-yl)propanoylamino]benzoate
Traditional Name:2-[3-(3H-benz[e]indazol-7-yl)propanoylamino]benzoic acid methyl ester
Formula: C22H19N3O3
MolecularWeight: 373.40456
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCC2=CC3=C(C=C2)C4=C(C=C3)NN=C4


Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCC2=CC3=C(C=C2)C4=C(C=C3)NN=C4


InChI

InChI=1S/C22H19N3O3/c1-28-22(27)17-4-2-3-5-19(17)24-21(26)11-7-14-6-9-16-15(12-14)8-10-20-18(16)13-23-25-20/h2-6,8-10,12-13H,7,11H2,1H3,(H,23,25)(H,24,26)


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