[(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-[(4-piperidin-1-ylcarbonylphenyl)methyl]azanium

Systemtic Name: [(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-[(4-piperidin-1-ylcarbonylphenyl)methyl]azanium Openeye Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenyl-ethyl]-[[4-(piperidine-1-carbonyl)phenyl]methyl]ammonium CAS Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[[4-[oxo(1-piperidinyl)methyl]phenyl]methyl]ammonium IUPAC Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-[[4-(piperidine-1-carbonyl)phenyl]methyl]azanium Traditional Name: [(1S)-2-keto-2-(o-phenetidino)-1-phenyl-ethyl]-[4-(piperidine-1-carbonyl)benzyl]ammonium Formula: C29H34N3O3+ MolecularWeight: 472.59856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)[NH2+]CC3=CC=C(C=C3)C(=O)N4CCCCC4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C2=CC=CC=C2)[NH2+]CC3=CC=C(C=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C29H33N3O3/c1-2-35-26-14-8-7-13-25(26)31-28(33)27(23-11-5-3-6-12-23)30-21-22-15-17-24(18-16-22)29(34)32-19-9-4-10-20-32/h3,5-8,11-18,27,30H,2,4,9-10,19-21H2,1H3,(H,31,33)/p+1/t27-/m0/s1