N-[1-[1-[2-(cyclohexylamino)-1-oxidanyl-2-oxidanylidene-ethyl]pyrrolidin-1-ium-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-phenoxy-benzamide

Systemtic Name: N-[1-[1-[2-(cyclohexylamino)-1-oxidanyl-2-oxidanylidene-ethyl]pyrrolidin-1-ium-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-3-phenoxy-benzamide Openeye Name: N-[1-[1-[2-(cyclohexylamino)-1-hydroxy-2-oxo-ethyl]pyrrolidin-1-ium-1-carbonyl]-2-methyl-propyl]-3-phenoxy-benzamide CAS Name: N-[1-[1-[2-(cyclohexylamino)-1-hydroxy-2-oxoethyl]-1-pyrrolidin-1-iumyl]-3-methyl-1-oxobutan-2-yl]-3-phenoxybenzamide IUPAC Name: N-[1-[1-[2-(cyclohexylamino)-1-hydroxy-2-oxoethyl]pyrrolidin-1-ium-1-yl]-3-methyl-1-oxobutan-2-yl]-3-phenoxybenzamide Traditional Name: N-[1-[1-[2-(cyclohexylamino)-1-hydroxy-2-keto-ethyl]pyrrolidin-1-ium-1-carbonyl]-2-methyl-propyl]-3-phenoxy-benzamide Formula: C30H40N3O5+ MolecularWeight: 522.6557

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[N+]1(CCCC1)C(C(=O)NC2CCCCC2)O)NC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)C(C(=O)[N+]1(CCCC1)C(C(=O)NC2CCCCC2)O)NC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C30H39N3O5/c1-21(2)26(32-27(34)22-12-11-17-25(20-22)38-24-15-7-4-8-16-24)29(36)33(18-9-10-19-33)30(37)28(35)31-23-13-5-3-6-14-23/h4,7-8,11-12,15-17,20-21,23,26,30,37H,3,5-6,9-10,13-14,18-19H2,1-2H3,(H-,31,32,34,35)/p+1