methyl 1-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-[4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanoyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-1-oxobutyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butanoyl]-4-phenyl-isonipecotic acid methyl ester Formula: C24H25N3O7 MolecularWeight: 467.4712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCN(CC1)C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1(CCN(CC1)C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)C4=CC=CC=C4

InChI

InChI=1S/C24H25N3O7/c1-33-22(29)24(17-6-3-2-4-7-17)11-14-25(15-12-24)21(28)8-5-13-26-19-10-9-18(27(31)32)16-20(19)34-23(26)30/h2-4,6-7,9-10,16H,5,8,11-15H2,1H3