2-chloranyl-N-[(2S)-3-methyl-1-[(1-methylpiperidin-4-yl)amino]-1-oxidanylidene-butan-2-yl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(2S)-3-methyl-1-[(1-methylpiperidin-4-yl)amino]-1-oxidanylidene-butan-2-yl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(1S)-2-methyl-1-[(1-methyl-4-piperidyl)carbamoyl]propyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[(2S)-3-methyl-1-[(1-methyl-4-piperidinyl)amino]-1-oxobutan-2-yl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(2S)-3-methyl-1-[(1-methylpiperidin-4-yl)amino]-1-oxobutan-2-yl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(1S)-2-methyl-1-[(1-methyl-4-piperidyl)carbamoyl]propyl]-4-nitro-benzamide Formula: C18H25ClN4O4 MolecularWeight: 396.8685

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCN(CC1)C)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1CCN(CC1)C)NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H25ClN4O4/c1-11(2)16(18(25)20-12-6-8-22(3)9-7-12)21-17(24)14-5-4-13(23(26)27)10-15(14)19/h4-5,10-12,16H,6-9H2,1-3H3,(H,20,25)(H,21,24)/t16-/m0/s1