2-[[(2R)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoyl]amino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[(2R)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoyl]amino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[(2R)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[(2R)-2-[[(4-ethoxyphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[(2R)-2-[(4-ethoxybenzoyl)amino]-3-methylbutanoyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[(2R)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoyl]amino]ethyl-diisopropyl-ammonium Formula: C22H38N3O3+ MolecularWeight: 392.55542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NCC[NH+](C(C)C)C(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N[C@H](C(C)C)C(=O)NCC[NH+](C(C)C)C(C)C

InChI

InChI=1S/C22H37N3O3/c1-8-28-19-11-9-18(10-12-19)21(26)24-20(15(2)3)22(27)23-13-14-25(16(4)5)17(6)7/h9-12,15-17,20H,8,13-14H2,1-7H3,(H,23,27)(H,24,26)/p+1/t20-/m1/s1