[(1S,2S,4S,5S)-4-azanyl-6-(2,2-dimethylhexanoylamino)-1-[1-(3-methoxypropyl)indazol-6-yl]-5-oxidanyl-2-propan-2-yl-hexyl] ethanoate

Systemtic Name: [(1S,2S,4S,5S)-4-azanyl-6-(2,2-dimethylhexanoylamino)-1-[1-(3-methoxypropyl)indazol-6-yl]-5-oxidanyl-2-propan-2-yl-hexyl] ethanoate Openeye Name: [(1S,2S,4S,5S)-4-amino-6-(2,2-dimethylhexanoylamino)-5-hydroxy-2-isopropyl-1-[1-(3-methoxypropyl)indazol-6-yl]hexyl] acetate CAS Name: acetic acid [(1S,2S,4S,5S)-4-amino-6-[(2,2-dimethyl-1-oxohexyl)amino]-5-hydroxy-1-[1-(3-methoxypropyl)-6-indazolyl]-2-propan-2-ylhexyl] ester IUPAC Name: [(1S,2S,4S,5S)-4-amino-6-(2,2-dimethylhexanoylamino)-5-hydroxy-1-[1-(3-methoxypropyl)indazol-6-yl]-2-propan-2-ylhexyl] acetate Traditional Name: acetic acid [(1S,2S,4S,5S)-4-amino-6-(2,2-dimethylhexanoylamino)-5-hydroxy-2-isopropyl-1-[1-(3-methoxypropyl)indazol-6-yl]hexyl] ester Formula: C30H50N4O5 MolecularWeight: 546.7418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(=O)NCC(C(CC(C(C)C)C(C1=CC2=C(C=C1)C=NN2CCCOC)OC(=O)C)N)O

Isomeric SMILES

CCCCC(C)(C)C(=O)NC[C@@H]([C@H](C[C@H]([C@@H](C1=CC2=C(C=C1)C=NN2CCCOC)OC(=O)C)C(C)C)N)O

InChI

InChI=1S/C30H50N4O5/c1-8-9-13-30(5,6)29(37)32-19-27(36)25(31)17-24(20(2)3)28(39-21(4)35)22-11-12-23-18-33-34(26(23)16-22)14-10-15-38-7/h11-12,16,18,20,24-25,27-28,36H,8-10,13-15,17,19,31H2,1-7H3,(H,32,37)/t24-,25-,27-,28+/m0/s1