(phenylmethyl) N-[(5S)-5-azanyl-6-(3-cyclooctylpropylamino)-6-oxidanylidene-hexyl]carbamate

Systemtic Name: (phenylmethyl) N-[(5S)-5-azanyl-6-(3-cyclooctylpropylamino)-6-oxidanylidene-hexyl]carbamate Openeye Name: benzyl N-[(5S)-5-amino-6-(3-cyclooctylpropylamino)-6-oxo-hexyl]carbamate CAS Name: N-[(5S)-5-amino-6-(3-cyclooctylpropylamino)-6-oxohexyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(5S)-5-amino-6-(3-cyclooctylpropylamino)-6-oxohexyl]carbamate Traditional Name: N-[(5S)-5-amino-6-(3-cyclooctylpropylamino)-6-keto-hexyl]carbamic acid benzyl ester Formula: C25H41N3O3 MolecularWeight: 431.61134

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)CCCNC(=O)C(CCCCNC(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

C1CCCC(CCC1)CCCNC(=O)[C@H](CCCCNC(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C25H41N3O3/c26-23(24(29)27-19-11-16-21-12-5-2-1-3-6-13-21)17-9-10-18-28-25(30)31-20-22-14-7-4-8-15-22/h4,7-8,14-15,21,23H,1-3,5-6,9-13,16-20,26H2,(H,27,29)(H,28,30)/t23-/m0/s1