(2S,8S)-2-azido-8-(tert-butylamino)-7-oxidanylidene-4,9-diphenyl-nonanoate

Systemtic Name: (2S,8S)-2-azido-8-(tert-butylamino)-7-oxidanylidene-4,9-diphenyl-nonanoate Openeye Name: (2S,8S)-2-azido-8-(tert-butylamino)-7-oxo-4,9-diphenyl-nonanoate CAS Name: (2S,8S)-2-azido-8-(tert-butylamino)-7-oxo-4,9-diphenylnonanoate IUPAC Name: (2S,8S)-2-azido-8-(tert-butylamino)-7-oxo-4,9-diphenylnonanoate Traditional Name: (2S,8S)-2-azido-8-(tert-butylamino)-7-keto-4,9-diphenyl-pelargonate Formula: C25H31N4O3- MolecularWeight: 435.53864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(CC1=CC=CC=C1)C(=O)CCC(CC(C(=O)[O-])N=[N+]=[N-])C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)N[C@@H](CC1=CC=CC=C1)C(=O)CCC(C[C@@H](C(=O)[O-])N=[N+]=[N-])C2=CC=CC=C2

InChI

InChI=1S/C25H32N4O3/c1-25(2,3)27-21(16-18-10-6-4-7-11-18)23(30)15-14-20(19-12-8-5-9-13-19)17-22(24(31)32)28-29-26/h4-13,20-22,27H,14-17H2,1-3H3,(H,31,32)/p-1/t20?,21-,22-/m0/s1