4-chloranyl-N-[3-(3-ethoxypropylcarbamoyl)-4-piperidin-1-yl-phenyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[3-(3-ethoxypropylcarbamoyl)-4-piperidin-1-yl-phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[3-(3-ethoxypropylcarbamoyl)-4-(1-piperidyl)phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[3-[(3-ethoxypropylamino)-oxomethyl]-4-(1-piperidinyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[3-(3-ethoxypropylcarbamoyl)-4-piperidin-1-ylphenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[3-(3-ethoxypropylcarbamoyl)-4-piperidino-phenyl]-3-nitro-benzamide Formula: C24H29ClN4O5 MolecularWeight: 488.96386

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C24H29ClN4O5/c1-2-34-14-6-11-26-24(31)19-16-18(8-10-21(19)28-12-4-3-5-13-28)27-23(30)17-7-9-20(25)22(15-17)29(32)33/h7-10,15-16H,2-6,11-14H2,1H3,(H,26,31)(H,27,30)