(3R)-3-[(4-phenoxyphenyl)carbamoylamino]-4-(trimethylazaniumyl)butanoate

Systemtic Name: (3R)-3-[(4-phenoxyphenyl)carbamoylamino]-4-(trimethylazaniumyl)butanoate Openeye Name: (3R)-3-[(4-phenoxyphenyl)carbamoylamino]-4-(trimethylammonio)butanoate CAS Name: (3R)-3-[[oxo-(4-phenoxyanilino)methyl]amino]-4-(trimethylammonio)butanoate IUPAC Name: (3R)-3-[(4-phenoxyphenyl)carbamoylamino]-4-(trimethylazaniumyl)butanoate Traditional Name: (3R)-3-[(4-phenoxyphenyl)carbamoylamino]-4-(trimethylammonio)butyrate Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)[O-])NC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

C[N+](C)(C)C[C@@H](CC(=O)[O-])NC(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C20H25N3O4/c1-23(2,3)14-16(13-19(24)25)22-20(26)21-15-9-11-18(12-10-15)27-17-7-5-4-6-8-17/h4-12,16H,13-14H2,1-3H3,(H2-,21,22,24,25,26)/t16-/m1/s1