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

Systemtic Name: 4-chloranyl-N-[3-(cyclopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[3-(cyclopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[3-[(cyclopropylamino)-oxomethyl]-4-[4-(2-methoxyphenyl)-1-piperazinyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[3-(cyclopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]phenyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[3-(cyclopropylcarbamoyl)-4-[4-(2-methoxyphenyl)piperazino]phenyl]-3-nitro-benzamide Formula: C28H28ClN5O5 MolecularWeight: 550.00542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C(=O)NC5CC5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C(=O)NC5CC5

InChI

InChI=1S/C28H28ClN5O5/c1-39-26-5-3-2-4-24(26)33-14-12-32(13-15-33)23-11-9-20(17-21(23)28(36)30-19-7-8-19)31-27(35)18-6-10-22(29)25(16-18)34(37)38/h2-6,9-11,16-17,19H,7-8,12-15H2,1H3,(H,30,36)(H,31,35)