N-[(2S)-1-[5-(2-azanylethylamino)pentylamino]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]butanamide

Systemtic Name: N-[(2S)-1-[5-(2-azanylethylamino)pentylamino]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]butanamide Openeye Name: N-[(1S)-2-[5-(2-aminoethylamino)pentylamino]-1-[(4-hydroxyphenyl)methyl]-2-oxo-ethyl]butanamide CAS Name: N-[(2S)-1-[5-(2-aminoethylamino)pentylamino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]butanamide IUPAC Name: N-[(2S)-1-[5-(2-aminoethylamino)pentylamino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]butanamide Traditional Name: N-[(1S)-2-[5-(2-aminoethylamino)pentylamino]-1-(4-hydroxybenzyl)-2-keto-ethyl]butyramide Formula: C20H34N4O3 MolecularWeight: 378.50896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(CC1=CC=C(C=C1)O)C(=O)NCCCCCNCCN

Isomeric SMILES

CCCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NCCCCCNCCN

InChI

InChI=1S/C20H34N4O3/c1-2-6-19(26)24-18(15-16-7-9-17(25)10-8-16)20(27)23-13-5-3-4-12-22-14-11-21/h7-10,18,22,25H,2-6,11-15,21H2,1H3,(H,23,27)(H,24,26)/t18-/m0/s1