tert-butyl (NE)-N-[2-[butanoyl(piperidin-4-yl)carbamoyl]-1-(methylamino)pyrrolidin-3-ylidene]carbamate

Systemtic Name: tert-butyl (NE)-N-[2-[butanoyl(piperidin-4-yl)carbamoyl]-1-(methylamino)pyrrolidin-3-ylidene]carbamate Openeye Name: tert-butyl (NE)-N-[2-[butanoyl(4-piperidyl)carbamoyl]-1-(methylamino)pyrrolidin-3-ylidene]carbamate CAS Name: (NE)-N-[1-(methylamino)-2-[oxo-[1-oxobutyl(4-piperidinyl)amino]methyl]-3-pyrrolidinylidene]carbamic acid tert-butyl ester IUPAC Name: tert-butyl (NE)-N-[2-[butanoyl(piperidin-4-yl)carbamoyl]-1-(methylamino)pyrrolidin-3-ylidene]carbamate Traditional Name: (NE)-N-[2-[butyryl(4-piperidyl)carbamoyl]-1-(methylamino)pyrrolidin-3-ylidene]carbamic acid tert-butyl ester Formula: C20H35N5O4 MolecularWeight: 409.523

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1CCNCC1)C(=O)C2C(=NC(=O)OC(C)(C)C)CCN2NC

Isomeric SMILES

CCCC(=O)N(C1CCNCC1)C(=O)C2/C(=N/C(=O)OC(C)(C)C)/CCN2NC

InChI

InChI=1S/C20H35N5O4/c1-6-7-16(26)25(14-8-11-22-12-9-14)18(27)17-15(10-13-24(17)21-5)23-19(28)29-20(2,3)4/h14,17,21-22H,6-13H2,1-5H3/b23-15+