benzamido-ethoxycarbonyl-[(4-hydroxyphenyl)methyl]-(2-methylpropyl)azanium

Systemtic Name: benzamido-ethoxycarbonyl-[(4-hydroxyphenyl)methyl]-(2-methylpropyl)azanium Openeye Name: benzamido-ethoxycarbonyl-[(4-hydroxyphenyl)methyl]-isobutyl-ammonium CAS Name: benzamido-ethoxycarbonyl-[(4-hydroxyphenyl)methyl]-(2-methylpropyl)ammonium IUPAC Name: benzamido-ethoxycarbonyl-[(4-hydroxyphenyl)methyl]-(2-methylpropyl)azanium Traditional Name: benzamido-carbethoxy-(4-hydroxybenzyl)-isobutyl-ammonium Formula: C21H27N2O4+ MolecularWeight: 371.45008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4/c1-4-27-21(26)23(14-16(2)3,15-17-10-12-19(24)13-11-17)22-20(25)18-8-6-5-7-9-18/h5-13,16H,4,14-15H2,1-3H3,(H-,22,24,25)/p+1