methyl 3-[(3-piperidin-1-ylcarbonyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl)amino]propanoate

Systemtic Name: methyl 3-[(3-piperidin-1-ylcarbonyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl)amino]propanoate Openeye Name: methyl 3-[[1-allyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate CAS Name: 3-[[3-[oxo(1-piperidinyl)methyl]-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[3-(piperidine-1-carbonyl)-1-prop-2-enyl-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate Traditional Name: 3-[[1-allyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]amino]propionic acid methyl ester Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC1CCC2=C(C1)C(=NN2CC=C)C(=O)N3CCCCC3

Isomeric SMILES

COC(=O)CCNC1CCC2=C(C1)C(=NN2CC=C)C(=O)N3CCCCC3

InChI

InChI=1S/C20H30N4O3/c1-3-11-24-17-8-7-15(21-10-9-18(25)27-2)14-16(17)19(22-24)20(26)23-12-5-4-6-13-23/h3,15,21H,1,4-14H2,2H3