ethyl-[2-oxidanylidene-2-[(4-propan-2-yloxycarbonylphenyl)amino]ethyl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[2-oxidanylidene-2-[(4-propan-2-yloxycarbonylphenyl)amino]ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[2-(4-isopropoxycarbonylanilino)-2-oxo-ethyl]ammonium CAS Name: ethyl-[2-oxo-2-[4-[oxo(propan-2-yloxy)methyl]anilino]ethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[2-oxo-2-(4-propan-2-yloxycarbonylanilino)ethyl]azanium Traditional Name: benzyl-ethyl-[2-(4-isopropoxycarbonylanilino)-2-keto-ethyl]ammonium Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)C(=O)OC(C)C

InChI

InChI=1S/C21H26N2O3/c1-4-23(14-17-8-6-5-7-9-17)15-20(24)22-19-12-10-18(11-13-19)21(25)26-16(2)3/h5-13,16H,4,14-15H2,1-3H3,(H,22,24)/p+1