(3-acetamido-5-pyrrolidin-1-ylcarbonyl-phenyl)methyl-[(1,3-diphenylpyrazol-4-yl)methyl]azanium

Systemtic Name: (3-acetamido-5-pyrrolidin-1-ylcarbonyl-phenyl)methyl-[(1,3-diphenylpyrazol-4-yl)methyl]azanium Openeye Name: [3-acetamido-5-(pyrrolidine-1-carbonyl)phenyl]methyl-[(1,3-diphenylpyrazol-4-yl)methyl]ammonium CAS Name: [3-acetamido-5-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl-[(1,3-diphenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [3-acetamido-5-(pyrrolidine-1-carbonyl)phenyl]methyl-[(1,3-diphenylpyrazol-4-yl)methyl]azanium Traditional Name: [3-acetamido-5-(pyrrolidine-1-carbonyl)benzyl]-[(1,3-diphenylpyrazol-4-yl)methyl]ammonium Formula: C30H32N5O2+ MolecularWeight: 494.60738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C[NH2+]CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)N5CCCC5

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C[NH2+]CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)N5CCCC5

InChI

InChI=1S/C30H31N5O2/c1-22(36)32-27-17-23(16-25(18-27)30(37)34-14-8-9-15-34)19-31-20-26-21-35(28-12-6-3-7-13-28)33-29(26)24-10-4-2-5-11-24/h2-7,10-13,16-18,21,31H,8-9,14-15,19-20H2,1H3,(H,32,36)/p+1