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

Systemtic Name: 2-chloranyl-N-[(2S)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(1S)-1-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-2-methyl-propyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[(2S)-1-[4-(2-methoxyphenyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(2S)-1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(1S)-1-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-2-methyl-propyl]-4-nitro-benzamide Formula: C23H27ClN4O5 MolecularWeight: 474.93728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=CC=CC=C2OC)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)C2=CC=CC=C2OC)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H27ClN4O5/c1-15(2)21(25-22(29)17-9-8-16(28(31)32)14-18(17)24)23(30)27-12-10-26(11-13-27)19-6-4-5-7-20(19)33-3/h4-9,14-15,21H,10-13H2,1-3H3,(H,25,29)/t21-/m0/s1