N-[2-(3-chloranyl-4-methoxy-phenyl)-6-methyl-benzotriazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2-(3-chloranyl-4-methoxy-phenyl)-6-methyl-benzotriazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(3-chloro-4-methoxy-phenyl)-6-methyl-benzotriazol-5-yl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-(3-chloro-4-methoxyphenyl)-6-methyl-5-benzotriazolyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-(3-chloro-4-methoxyphenyl)-6-methylbenzotriazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(3-chloro-4-methoxy-phenyl)-6-methyl-benzotriazol-5-yl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C27H27ClN6O4 MolecularWeight: 534.99408

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=NN(N=C4C=C3C)C5=CC(=C(C=C5)OC)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=NN(N=C4C=C3C)C5=CC(=C(C=C5)OC)Cl)[N+](=O)[O-]

InChI

InChI=1S/C27H27ClN6O4/c1-16-8-10-32(11-9-16)24-6-4-18(13-25(24)34(36)37)27(35)29-21-15-23-22(12-17(21)2)30-33(31-23)19-5-7-26(38-3)20(28)14-19/h4-7,12-16H,8-11H2,1-3H3,(H,29,35)