(2R)-2-azanyl-N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-3-phenylmethoxy-butanamide

Systemtic Name: (2R)-2-azanyl-N-[3-[4-(3-azanylpropylamino)butylamino]propyl]-3-phenylmethoxy-butanamide Openeye Name: (2R)-2-amino-N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3-benzyloxy-butanamide CAS Name: (2R)-2-amino-N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3-phenylmethoxybutanamide IUPAC Name: (2R)-2-amino-N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3-phenylmethoxybutanamide Traditional Name: (2R)-2-amino-N-[3-[4-(3-aminopropylamino)butylamino]propyl]-3-benzoxy-butyramide Formula: C21H39N5O2 MolecularWeight: 393.56666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NCCCNCCCCNCCCN)N)OCC1=CC=CC=C1

Isomeric SMILES

CC([C@H](C(=O)NCCCNCCCCNCCCN)N)OCC1=CC=CC=C1

InChI

InChI=1S/C21H39N5O2/c1-18(28-17-19-9-3-2-4-10-19)20(23)21(27)26-16-8-15-25-13-6-5-12-24-14-7-11-22/h2-4,9-10,18,20,24-25H,5-8,11-17,22-23H2,1H3,(H,26,27)/t18?,20-/m1/s1