(1-butyl-1,2,3,4-tetrazol-5-yl)methyl (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate Openeye Name: (1-butyltetrazol-5-yl)methyl (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]butanoic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl (2S)-3-methyl-2-[(2-naphthalen-1-ylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butyric acid (1-butyltetrazol-5-yl)methyl ester Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C(C(C)C)NC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)[C@H](C(C)C)NC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H29N5O3/c1-4-5-13-28-20(25-26-27-28)15-31-23(30)22(16(2)3)24-21(29)14-18-11-8-10-17-9-6-7-12-19(17)18/h6-12,16,22H,4-5,13-15H2,1-3H3,(H,24,29)/t22-/m0/s1