(2-azanyl-2-oxidanylidene-ethyl)-[2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-oxidanylidene-ethyl]-cyclopentyl-azanium

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl)-[2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-oxidanylidene-ethyl]-cyclopentyl-azanium Openeye Name: (2-amino-2-oxo-ethyl)-[2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-oxo-ethyl]-cyclopentyl-ammonium CAS Name: (2-amino-2-oxoethyl)-[2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-2-pyrrolyl)amino]-2-oxoethyl]-cyclopentylammonium IUPAC Name: (2-amino-2-oxoethyl)-[2-[(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)amino]-2-oxoethyl]-cyclopentylazanium Traditional Name: (2-amino-2-keto-ethyl)-[2-[(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-keto-ethyl]-cyclopentyl-ammonium Formula: C22H34N5O2+ MolecularWeight: 400.53766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)C[NH+](CC(=O)N)C2CCCC2)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)C[NH+](CC(=O)N)C2CCCC2)C3CCCCC3)C

InChI

InChI=1S/C22H33N5O2/c1-15-16(2)27(18-10-4-3-5-11-18)22(19(15)12-23)25-21(29)14-26(13-20(24)28)17-8-6-7-9-17/h17-18H,3-11,13-14H2,1-2H3,(H2,24,28)(H,25,29)/p+1