methyl 2-[[3-(2-cyano-3-oxidanylidene-3-phenylazanyl-propanoyl)-1-phenyl-4H-indeno[1,2-c]pyrazol-7-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[3-(2-cyano-3-oxidanylidene-3-phenylazanyl-propanoyl)-1-phenyl-4H-indeno[1,2-c]pyrazol-7-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[3-(3-anilino-2-cyano-3-oxo-propanoyl)-1-phenyl-4H-indeno[1,2-c]pyrazole-7-carbonyl]amino]acetate CAS Name: 2-[[[3-(3-anilino-2-cyano-1,3-dioxopropyl)-1-phenyl-4H-indeno[1,2-c]pyrazol-7-yl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-(3-anilino-2-cyano-3-oxopropanoyl)-1-phenyl-4H-indeno[1,2-c]pyrazole-7-carbonyl]amino]acetate Traditional Name: 2-[[3-(3-anilino-2-cyano-3-keto-propanoyl)-1-phenyl-4H-indeno[1,2-c]pyrazole-7-carbonyl]amino]acetic acid methyl ester Formula: C30H23N5O5 MolecularWeight: 533.53412

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC2=C(CC3=C2N(N=C3C(=O)C(C#N)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5)C=C1

Isomeric SMILES

COC(=O)CNC(=O)C1=CC2=C(CC3=C2N(N=C3C(=O)C(C#N)C(=O)NC4=CC=CC=C4)C5=CC=CC=C5)C=C1

InChI

InChI=1S/C30H23N5O5/c1-40-25(36)17-32-29(38)19-13-12-18-14-23-26(28(37)24(16-31)30(39)33-20-8-4-2-5-9-20)34-35(27(23)22(18)15-19)21-10-6-3-7-11-21/h2-13,15,24H,14,17H2,1H3,(H,32,38)(H,33,39)