N-[(2S)-3-methyl-1-oxidanylidene-1-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-3-methyl-1-oxidanylidene-1-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-1-[4-[(4-isopropylphenyl)methyl]piperazin-4-ium-1-carbonyl]-2-methyl-propyl]furan-2-carboxamide CAS Name: N-[(2S)-3-methyl-1-oxo-1-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-4-iumyl]butan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-3-methyl-1-oxo-1-[4-[(4-propan-2-ylphenyl)methyl]piperazin-4-ium-1-yl]butan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-1-[4-(4-isopropylbenzyl)piperazin-4-ium-1-carbonyl]-2-methyl-propyl]-2-furamide Formula: C24H34N3O3+ MolecularWeight: 412.54506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C(C(C)C)NC(=O)C3=CC=CO3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)[C@H](C(C)C)NC(=O)C3=CC=CO3

InChI

InChI=1S/C24H33N3O3/c1-17(2)20-9-7-19(8-10-20)16-26-11-13-27(14-12-26)24(29)22(18(3)4)25-23(28)21-6-5-15-30-21/h5-10,15,17-18,22H,11-14,16H2,1-4H3,(H,25,28)/p+1/t22-/m0/s1