methyl 5-[3-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)propyl]furan-2-carboxylate

Systemtic Name: methyl 5-[3-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)propyl]furan-2-carboxylate Openeye Name: methyl 5-[3-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)propyl]furan-2-carboxylate CAS Name: 5-[3-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)propyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[3-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)propyl]furan-2-carboxylate Traditional Name: 5-[3-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)propyl]furan-2-carboxylic acid methyl ester Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CCCC2CCCCC(=N2)N

Isomeric SMILES

COC(=O)C1=CC=C(O1)CCCC2CCCCC(=N2)N

InChI

InChI=1S/C15H22N2O3/c1-19-15(18)13-10-9-12(20-13)7-4-6-11-5-2-3-8-14(16)17-11/h9-11H,2-8H2,1H3,(H2,16,17)