methyl 2,4-dimethyl-5-[[(2S)-3-methyl-2-morpholin-4-ium-4-yl-butyl]carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[[(2S)-3-methyl-2-morpholin-4-ium-4-yl-butyl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[[(2S)-3-methyl-2-morpholin-4-ium-4-yl-butyl]carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[[(2S)-3-methyl-2-(4-morpholin-4-iumyl)butyl]amino]-oxomethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[[(2S)-3-methyl-2-morpholin-4-ium-4-ylbutyl]carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[[(2S)-3-methyl-2-morpholin-4-ium-4-yl-butyl]carbamoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H30N3O4+ MolecularWeight: 352.4485

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NCC(C(C)C)[NH+]2CCOCC2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC[C@H](C(C)C)[NH+]2CCOCC2

InChI

InChI=1S/C18H29N3O4/c1-11(2)14(21-6-8-25-9-7-21)10-19-17(22)16-12(3)15(13(4)20-16)18(23)24-5/h11,14,20H,6-10H2,1-5H3,(H,19,22)/p+1/t14-/m1/s1