(3S,4S)-N-butyl-6-methyl-4-[[(2S)-2-(2-naphthalen-2-yloxyethanoylamino)-2-phenyl-ethanoyl]amino]-3-oxidanyl-heptanamide

Systemtic Name: (3S,4S)-N-butyl-6-methyl-4-[[(2S)-2-(2-naphthalen-2-yloxyethanoylamino)-2-phenyl-ethanoyl]amino]-3-oxidanyl-heptanamide Openeye Name: (3S,4S)-N-butyl-3-hydroxy-6-methyl-4-[[(2S)-2-[[2-(2-naphthyloxy)acetyl]amino]-2-phenyl-acetyl]amino]heptanamide CAS Name: (3S,4S)-N-butyl-3-hydroxy-6-methyl-4-[[(2S)-2-[[2-(2-naphthalenyloxy)-1-oxoethyl]amino]-1-oxo-2-phenylethyl]amino]heptanamide IUPAC Name: (3S,4S)-N-butyl-3-hydroxy-6-methyl-4-[[(2S)-2-[(2-naphthalen-2-yloxyacetyl)amino]-2-phenylacetyl]amino]heptanamide Traditional Name: (3S,4S)-N-butyl-3-hydroxy-6-methyl-4-[[(2S)-2-[[2-(2-naphthoxy)acetyl]amino]-2-phenyl-acetyl]amino]enanthamide Formula: C32H41N3O5 MolecularWeight: 547.68504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC(C(CC(C)C)NC(=O)C(C1=CC=CC=C1)NC(=O)COC2=CC3=CC=CC=C3C=C2)O

Isomeric SMILES

CCCCNC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](C1=CC=CC=C1)NC(=O)COC2=CC3=CC=CC=C3C=C2)O

InChI

InChI=1S/C32H41N3O5/c1-4-5-17-33-29(37)20-28(36)27(18-22(2)3)34-32(39)31(24-12-7-6-8-13-24)35-30(38)21-40-26-16-15-23-11-9-10-14-25(23)19-26/h6-16,19,22,27-28,31,36H,4-5,17-18,20-21H2,1-3H3,(H,33,37)(H,34,39)(H,35,38)/t27-,28-,31-/m0/s1