methyl 1-[2-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[2-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-[2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]pyrrolidine-2-carboxylate CAS Name: 1-[2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-2-yl)ethyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C14H25N3O2 MolecularWeight: 267.3672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1CCC2CCCCC(=N2)N

Isomeric SMILES

COC(=O)C1CCCN1CCC2CCCCC(=N2)N

InChI

InChI=1S/C14H25N3O2/c1-19-14(18)12-6-4-9-17(12)10-8-11-5-2-3-7-13(15)16-11/h11-12H,2-10H2,1H3,(H2,15,16)