methyl 5-[[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[[1-(2-amino-2-oxo-ethyl)-4-piperidyl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[[1-(2-amino-2-oxoethyl)-4-piperidinyl]amino]-oxomethyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[[1-(2-amino-2-oxoethyl)piperidin-4-yl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[1-(2-amino-2-keto-ethyl)-4-piperidyl]carbamoyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C17H26N4O4 MolecularWeight: 350.41274

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2CCN(CC2)CC(=O)N)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2CCN(CC2)CC(=O)N)C)C(=O)OC

InChI

InChI=1S/C17H26N4O4/c1-4-12-14(17(24)25-3)10(2)15(20-12)16(23)19-11-5-7-21(8-6-11)9-13(18)22/h11,20H,4-9H2,1-3H3,(H2,18,22)(H,19,23)