methyl 1-[4-(1H-indol-2-ylcarbonylamino)butanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[4-(1H-indol-2-ylcarbonylamino)butanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[4-(1H-indole-2-carbonylamino)butanoyl]piperidine-4-carboxylate CAS Name: 1-[4-[[1H-indol-2-yl(oxo)methyl]amino]-1-oxobutyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(1H-indole-2-carbonylamino)butanoyl]piperidine-4-carboxylate Traditional Name: 1-[4-(1H-indole-2-carbonylamino)butanoyl]isonipecotic acid methyl ester Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CCCNC(=O)C2=CC3=CC=CC=C3N2

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CCCNC(=O)C2=CC3=CC=CC=C3N2

InChI

InChI=1S/C20H25N3O4/c1-27-20(26)14-8-11-23(12-9-14)18(24)7-4-10-21-19(25)17-13-15-5-2-3-6-16(15)22-17/h2-3,5-6,13-14,22H,4,7-12H2,1H3,(H,21,25)