1-[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-N-(2-methoxyphenyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-N-(2-methoxyphenyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl]-N-(2-methoxyphenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]-N-(2-methoxyphenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl]-N-(2-methoxyphenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl]-N-(2-methoxyphenyl)piperidin-1-ium-4-carboxamide Formula: C19H29N4O4+ MolecularWeight: 377.45796

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)[NH+]1CCC(CC1)C(=O)NC2=CC=CC=C2OC

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)[NH+]1CCC(CC1)C(=O)NC2=CC=CC=C2OC

InChI

InChI=1S/C19H28N4O4/c1-4-20-19(26)22-17(24)13(2)23-11-9-14(10-12-23)18(25)21-15-7-5-6-8-16(15)27-3/h5-8,13-14H,4,9-12H2,1-3H3,(H,21,25)(H2,20,22,24,26)/p+1/t13-/m0/s1