[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: [2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: [2-[(1-ethoxycarbonyl-4-piperidyl)amino]-2-oxo-ethyl]-[(4-isopropylphenyl)methyl]-methyl-ammonium CAS Name: [2-[(1-ethoxycarbonyl-4-piperidinyl)amino]-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: [2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: [2-[(1-carbethoxy-4-piperidyl)amino]-2-keto-ethyl]-(4-isopropylbenzyl)-methyl-ammonium Formula: C21H34N3O3+ MolecularWeight: 376.51296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H33N3O3/c1-5-27-21(26)24-12-10-19(11-13-24)22-20(25)15-23(4)14-17-6-8-18(9-7-17)16(2)3/h6-9,16,19H,5,10-15H2,1-4H3,(H,22,25)/p+1