[(2S,3R)-1-[(4-ethoxycarbonylphenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3R)-1-[(4-ethoxycarbonylphenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2R)-1-[(4-ethoxycarbonylphenyl)carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3R)-1-(4-ethoxycarbonylanilino)-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3R)-1-(4-ethoxycarbonylanilino)-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2R)-1-[(4-carbethoxyphenyl)carbamoyl]-2-methyl-butyl]ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC=C(C=C1)C(=O)OCC)[NH3+]

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)NC1=CC=C(C=C1)C(=O)OCC)[NH3+]

InChI

InChI=1S/C15H22N2O3/c1-4-10(3)13(16)14(18)17-12-8-6-11(7-9-12)15(19)20-5-2/h6-10,13H,4-5,16H2,1-3H3,(H,17,18)/p+1/t10-,13+/m1/s1