N-heptan-2-yl-3-(pyrrolidin-1-ylmethyl)aniline

Systemtic Name: N-heptan-2-yl-3-(pyrrolidin-1-ylmethyl)aniline Openeye Name: N-(1-methylhexyl)-3-(pyrrolidin-1-ylmethyl)aniline CAS Name: N-heptan-2-yl-3-(1-pyrrolidinylmethyl)aniline IUPAC Name: N-heptan-2-yl-3-(pyrrolidin-1-ylmethyl)aniline Traditional Name: 1-methylhexyl-[3-(pyrrolidinomethyl)phenyl]amine Formula: C18H30N2 MolecularWeight: 274.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1=CC=CC(=C1)CN2CCCC2

Isomeric SMILES

CCCCCC(C)NC1=CC=CC(=C1)CN2CCCC2

InChI

InChI=1S/C18H30N2/c1-3-4-5-9-16(2)19-18-11-8-10-17(14-18)15-20-12-6-7-13-20/h8,10-11,14,16,19H,3-7,9,12-13,15H2,1-2H3