N-[(2S)-3-(4-hydroxyphenyl)-1-[6-[8-[6-[(2-methoxyphenyl)methylamino]hexylamino]octylamino]hexylamino]-1-oxidanylidene-propan-2-yl]butanamide

Systemtic Name: N-[(2S)-3-(4-hydroxyphenyl)-1-[6-[8-[6-[(2-methoxyphenyl)methylamino]hexylamino]octylamino]hexylamino]-1-oxidanylidene-propan-2-yl]butanamide Openeye Name: N-[(1S)-1-[(4-hydroxyphenyl)methyl]-2-[6-[8-[6-[(2-methoxyphenyl)methylamino]hexylamino]octylamino]hexylamino]-2-oxo-ethyl]butanamide CAS Name: N-[(2S)-3-(4-hydroxyphenyl)-1-[6-[8-[6-[(2-methoxyphenyl)methylamino]hexylamino]octylamino]hexylamino]-1-oxopropan-2-yl]butanamide IUPAC Name: N-[(2S)-3-(4-hydroxyphenyl)-1-[6-[8-[6-[(2-methoxyphenyl)methylamino]hexylamino]octylamino]hexylamino]-1-oxopropan-2-yl]butanamide Traditional Name: N-[(1S)-1-(4-hydroxybenzyl)-2-keto-2-[6-[8-[6-(o-anisylamino)hexylamino]octylamino]hexylamino]ethyl]butyramide Formula: C41H69N5O4 MolecularWeight: 696.01766

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(CC1=CC=C(C=C1)O)C(=O)NCCCCCCNCCCCCCCCNCCCCCCNCC2=CC=CC=C2OC

Isomeric SMILES

CCCC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NCCCCCCNCCCCCCCCNCCCCCCNCC2=CC=CC=C2OC

InChI

InChI=1S/C41H69N5O4/c1-3-20-40(48)46-38(33-35-23-25-37(47)26-24-35)41(49)45-32-19-11-10-17-30-43-28-15-7-5-4-6-14-27-42-29-16-8-9-18-31-44-34-36-21-12-13-22-39(36)50-2/h12-13,21-26,38,42-44,47H,3-11,14-20,27-34H2,1-2H3,(H,45,49)(H,46,48)/t38-/m0/s1