4-chloranyl-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1-phenylethylcarbamoyl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1-phenylethylcarbamoyl)phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1-phenylethylcarbamoyl)phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-[oxo-(1-phenylethylamino)methyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(1-phenylethylcarbamoyl)phenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[4-[4-(2-methoxyphenyl)piperazino]-3-(1-phenylethylcarbamoyl)phenyl]-3-nitro-benzamide Formula: C33H32ClN5O5 MolecularWeight: 614.09068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C33H32ClN5O5/c1-22(23-8-4-3-5-9-23)35-33(41)26-21-25(36-32(40)24-12-14-27(34)30(20-24)39(42)43)13-15-28(26)37-16-18-38(19-17-37)29-10-6-7-11-31(29)44-2/h3-15,20-22H,16-19H2,1-2H3,(H,35,41)(H,36,40)