4-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[[(2R)-oxolan-2-yl]methylamino]butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[[(2R)-oxolan-2-yl]methylamino]butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-2-methyl-1-[[(2R)-tetrahydrofuran-2-yl]methylcarbamoyl]propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-3-methyl-1-oxo-1-[[(2R)-2-oxolanyl]methylamino]butan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-3-methyl-1-oxo-1-[[(2R)-oxolan-2-yl]methylamino]butan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-2-methyl-1-[[(2R)-tetrahydrofuran-2-yl]methylcarbamoyl]propyl]-3-nitro-benzamide Formula: C17H22ClN3O5 MolecularWeight: 383.82668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1CCCO1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC[C@H]1CCCO1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H22ClN3O5/c1-10(2)15(17(23)19-9-12-4-3-7-26-12)20-16(22)11-5-6-13(18)14(8-11)21(24)25/h5-6,8,10,12,15H,3-4,7,9H2,1-2H3,(H,19,23)(H,20,22)/t12-,15+/m1/s1