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

Systemtic Name: N-butyl-6-methyl-4-[[(2S)-2-(2-naphthalen-2-yloxyethanoylamino)-3-phenyl-propanoyl]amino]-3-oxidanyl-heptanamide Openeye Name: N-butyl-3-hydroxy-6-methyl-4-[[(2S)-2-[[2-(2-naphthyloxy)acetyl]amino]-3-phenyl-propanoyl]amino]heptanamide CAS Name: N-butyl-3-hydroxy-6-methyl-4-[[(2S)-2-[[2-(2-naphthalenyloxy)-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]heptanamide IUPAC Name: N-butyl-3-hydroxy-6-methyl-4-[[(2S)-2-[(2-naphthalen-2-yloxyacetyl)amino]-3-phenylpropanoyl]amino]heptanamide Traditional Name: N-butyl-3-hydroxy-6-methyl-4-[[(2S)-2-[[2-(2-naphthoxy)acetyl]amino]-3-phenyl-propanoyl]amino]enanthamide Formula: C33H43N3O5 MolecularWeight: 561.71162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC(C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)COC2=CC3=CC=CC=C3C=C2)O

Isomeric SMILES

CCCCNC(=O)CC(C(CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)COC2=CC3=CC=CC=C3C=C2)O

InChI

InChI=1S/C33H43N3O5/c1-4-5-17-34-31(38)21-30(37)28(18-23(2)3)36-33(40)29(19-24-11-7-6-8-12-24)35-32(39)22-41-27-16-15-25-13-9-10-14-26(25)20-27/h6-16,20,23,28-30,37H,4-5,17-19,21-22H2,1-3H3,(H,34,38)(H,35,39)(H,36,40)/t28?,29-,30?/m0/s1