tert-butyl N-[[(3R,4S)-4-[(4-aminophenyl)methyl]pyrrolidin-3-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[(3R,4S)-4-[(4-aminophenyl)methyl]pyrrolidin-3-yl]methyl]carbamate Openeye Name: tert-butyl N-[[(3R,4S)-4-[(4-aminophenyl)methyl]pyrrolidin-3-yl]methyl]carbamate CAS Name: N-[[(3R,4S)-4-[(4-aminophenyl)methyl]-3-pyrrolidinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[(3R,4S)-4-[(4-aminophenyl)methyl]pyrrolidin-3-yl]methyl]carbamate Traditional Name: N-[[(3R,4S)-4-(4-aminobenzyl)pyrrolidin-3-yl]methyl]carbamic acid tert-butyl ester Formula: C17H27N3O2 MolecularWeight: 305.41518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1CNCC1CC2=CC=C(C=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)NC[C@H]1CNC[C@H]1CC2=CC=C(C=C2)N

InChI

InChI=1S/C17H27N3O2/c1-17(2,3)22-16(21)20-11-14-10-19-9-13(14)8-12-4-6-15(18)7-5-12/h4-7,13-14,19H,8-11,18H2,1-3H3,(H,20,21)/t13-,14-/m1/s1