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

Systemtic Name: [(3S)-2,5-bis(oxidanylidene)-1-(4-propoxyphenyl)pyrrolidin-3-yl]-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]azanium Openeye Name: [(3S)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]ammonium CAS Name: [(3S)-2,5-dioxo-1-(4-propoxyphenyl)-3-pyrrolidinyl]-[2-(4-methyl-1-piperazine-1,4-diiumyl)ethyl]ammonium IUPAC Name: [(3S)-2,5-dioxo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]azanium Traditional Name: [(3S)-2,5-diketo-1-(4-propoxyphenyl)pyrrolidin-3-yl]-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]ammonium Formula: C20H33N4O3+3 MolecularWeight: 377.50102

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH2+]CC[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)C[C@@H](C2=O)[NH2+]CC[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C20H30N4O3/c1-3-14-27-17-6-4-16(5-7-17)24-19(25)15-18(20(24)26)21-8-9-23-12-10-22(2)11-13-23/h4-7,18,21H,3,8-15H2,1-2H3/p+3/t18-/m0/s1