tert-butyl N-[[1-[3-(butylaminomethyl)phenyl]pyrrolidin-3-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[1-[3-(butylaminomethyl)phenyl]pyrrolidin-3-yl]methyl]carbamate Openeye Name: tert-butyl N-[[1-[3-(butylaminomethyl)phenyl]pyrrolidin-3-yl]methyl]carbamate CAS Name: N-[[1-[3-(butylaminomethyl)phenyl]-3-pyrrolidinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[1-[3-(butylaminomethyl)phenyl]pyrrolidin-3-yl]methyl]carbamate Traditional Name: N-[[1-[3-(butylaminomethyl)phenyl]pyrrolidin-3-yl]methyl]carbamic acid tert-butyl ester Formula: C21H35N3O2 MolecularWeight: 361.5215

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=CC(=CC=C1)N2CCC(C2)CNC(=O)OC(C)(C)C

Isomeric SMILES

CCCCNCC1=CC(=CC=C1)N2CCC(C2)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C21H35N3O2/c1-5-6-11-22-14-17-8-7-9-19(13-17)24-12-10-18(16-24)15-23-20(25)26-21(2,3)4/h7-9,13,18,22H,5-6,10-12,14-16H2,1-4H3,(H,23,25)