tert-butyl 2-azanyl-4,5-dimethyl-1-(3-morpholin-4-ylpropyl)pyrrole-3-carboxylate

Systemtic Name: tert-butyl 2-azanyl-4,5-dimethyl-1-(3-morpholin-4-ylpropyl)pyrrole-3-carboxylate Openeye Name: tert-butyl 2-amino-4,5-dimethyl-1-(3-morpholinopropyl)pyrrole-3-carboxylate CAS Name: 2-amino-4,5-dimethyl-1-[3-(4-morpholinyl)propyl]-3-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-4,5-dimethyl-1-(3-morpholin-4-ylpropyl)pyrrole-3-carboxylate Traditional Name: 2-amino-4,5-dimethyl-1-(3-morpholinopropyl)pyrrole-3-carboxylic acid tert-butyl ester Formula: C18H31N3O3 MolecularWeight: 337.45704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C(=O)OC(C)(C)C)N)CCCN2CCOCC2)C

Isomeric SMILES

CC1=C(N(C(=C1C(=O)OC(C)(C)C)N)CCCN2CCOCC2)C

InChI

InChI=1S/C18H31N3O3/c1-13-14(2)21(8-6-7-20-9-11-23-12-10-20)16(19)15(13)17(22)24-18(3,4)5/h6-12,19H2,1-5H3