N-[2-[4-(diethylamino)-2-methyl-phenyl]-6-methyl-benzotriazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[2-[4-(diethylamino)-2-methyl-phenyl]-6-methyl-benzotriazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[2-[4-(diethylamino)-2-methyl-phenyl]-6-methyl-benzotriazol-5-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-[4-(diethylamino)-2-methylphenyl]-6-methyl-5-benzotriazolyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-[4-(diethylamino)-2-methylphenyl]-6-methylbenzotriazol-5-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[2-[4-(diethylamino)-2-methyl-phenyl]-6-methyl-benzotriazol-5-yl]-3-nitro-4-piperidino-benzamide Formula: C30H35N7O3 MolecularWeight: 541.644

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-])C)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-])C)C

InChI

InChI=1S/C30H35N7O3/c1-5-34(6-2)23-11-13-27(21(4)16-23)36-32-25-17-20(3)24(19-26(25)33-36)31-30(38)22-10-12-28(29(18-22)37(39)40)35-14-8-7-9-15-35/h10-13,16-19H,5-9,14-15H2,1-4H3,(H,31,38)