[(3S)-2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]-cyclohexyl-azanium

Systemtic Name: [(3S)-2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]-cyclohexyl-azanium Openeye Name: cyclohexyl-[(3S)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]ammonium CAS Name: cyclohexyl-[(3S)-2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]ammonium IUPAC Name: cyclohexyl-[(3S)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]azanium Traditional Name: cyclohexyl-[(3S)-2,5-diketo-1-(4-propoxyphenyl)pyrrolidin-3-yl]ammonium Formula: C19H27N2O3+ MolecularWeight: 331.42928

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH2+]C3CCCCC3

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)[NH2+]C3CCCCC3

InChI

InChI=1S/C19H26N2O3/c1-2-12-24-16-10-8-15(9-11-16)21-18(22)13-17(19(21)23)20-14-6-4-3-5-7-14/h8-11,14,17,20H,2-7,12-13H2,1H3/p+1/t17-/m0/s1