4-[bis(azanyl)methylideneamino]-N-[(3R,4R,5S,6R)-4-[(4-chlorophenyl)methoxy]-6-(methoxymethyl)-5-oxidanyl-2-[(4-phenylphenyl)methoxy]oxan-3-yl]butanamide

Systemtic Name: 4-[bis(azanyl)methylideneamino]-N-[(3R,4R,5S,6R)-4-[(4-chlorophenyl)methoxy]-6-(methoxymethyl)-5-oxidanyl-2-[(4-phenylphenyl)methoxy]oxan-3-yl]butanamide Openeye Name: N-[(3R,4R,5S,6R)-4-[(4-chlorophenyl)methoxy]-5-hydroxy-6-(methoxymethyl)-2-[(4-phenylphenyl)methoxy]tetrahydropyran-3-yl]-4-guanidino-butanamide CAS Name: N-[(3R,4R,5S,6R)-4-[(4-chlorophenyl)methoxy]-5-hydroxy-6-(methoxymethyl)-2-[(4-phenylphenyl)methoxy]-3-oxanyl]-4-(diaminomethylideneamino)butanamide IUPAC Name: N-[(3R,4R,5S,6R)-4-[(4-chlorophenyl)methoxy]-5-hydroxy-6-(methoxymethyl)-2-[(4-phenylphenyl)methoxy]oxan-3-yl]-4-(diaminomethylideneamino)butanamide Traditional Name: N-[(3R,4R,5S,6R)-4-(4-chlorobenzyl)oxy-5-hydroxy-6-(methoxymethyl)-2-(4-phenylbenzyl)oxy-tetrahydropyran-3-yl]-4-guanidino-butyramide Formula: C32H39ClN4O6 MolecularWeight: 611.12826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1C(C(C(C(O1)OCC2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)CCCN=C(N)N)OCC4=CC=C(C=C4)Cl)O

Isomeric SMILES

COC[C@@H]1[C@H]([C@@H]([C@H](C(O1)OCC2=CC=C(C=C2)C3=CC=CC=C3)NC(=O)CCCN=C(N)N)OCC4=CC=C(C=C4)Cl)O

InChI

InChI=1S/C32H39ClN4O6/c1-40-20-26-29(39)30(41-18-22-11-15-25(33)16-12-22)28(37-27(38)8-5-17-36-32(34)35)31(43-26)42-19-21-9-13-24(14-10-21)23-6-3-2-4-7-23/h2-4,6-7,9-16,26,28-31,39H,5,8,17-20H2,1H3,(H,37,38)(H4,34,35,36)/t26-,28-,29-,30-,31?/m1/s1