ethyl 3-[[3-(azepan-1-ylcarbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate

Systemtic Name: ethyl 3-[[3-(azepan-1-ylcarbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate Openeye Name: ethyl 3-[[3-(azepane-1-carbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate CAS Name: 3-[[3-[1-azepanyl(oxo)methyl]-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[3-(azepane-1-carbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate Traditional Name: 3-[[3-(azepane-1-carbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]amino]propionic acid ethyl ester Formula: C20H32N4O3 MolecularWeight: 376.49308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC1CCC2=C(C1)C(=NN2C)C(=O)N3CCCCCC3

Isomeric SMILES

CCOC(=O)CCNC1CCC2=C(C1)C(=NN2C)C(=O)N3CCCCCC3

InChI

InChI=1S/C20H32N4O3/c1-3-27-18(25)10-11-21-15-8-9-17-16(14-15)19(22-23(17)2)20(26)24-12-6-4-5-7-13-24/h15,21H,3-14H2,1-2H3