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

Systemtic Name: [2-[(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-oxidanylidene-ethyl]-bis(2-methoxyethyl)azanium Openeye Name: [2-[(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-oxo-ethyl]-bis(2-methoxyethyl)ammonium CAS Name: [2-[(3-cyano-1-cyclopentyl-4,5-dimethyl-2-pyrrolyl)amino]-2-oxoethyl]-bis(2-methoxyethyl)ammonium IUPAC Name: [2-[(3-cyano-1-cyclopentyl-4,5-dimethylpyrrol-2-yl)amino]-2-oxoethyl]-bis(2-methoxyethyl)azanium Traditional Name: [2-[(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)amino]-2-keto-ethyl]-bis(2-methoxyethyl)ammonium Formula: C20H33N4O3+ MolecularWeight: 377.50102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H32N4O3/c1-15-16(2)24(17-7-5-6-8-17)20(18(15)13-21)22-19(25)14-23(9-11-26-3)10-12-27-4/h17H,5-12,14H2,1-4H3,(H,22,25)/p+1