methyl 4-[[2-[1-oxidanylidene-4-[(2-oxidanyl-2-phenyl-ethyl)amino]-1-phenylazanyl-butan-2-yl]imidazol-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[2-[1-oxidanylidene-4-[(2-oxidanyl-2-phenyl-ethyl)amino]-1-phenylazanyl-butan-2-yl]imidazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[[2-[3-[(2-hydroxy-2-phenyl-ethyl)amino]-1-(phenylcarbamoyl)propyl]imidazol-1-yl]methyl]benzoate CAS Name: 4-[[2-[1-anilino-4-[(2-hydroxy-2-phenylethyl)amino]-1-oxobutan-2-yl]-1-imidazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[1-anilino-4-[(2-hydroxy-2-phenylethyl)amino]-1-oxobutan-2-yl]imidazol-1-yl]methyl]benzoate Traditional Name: 4-[[2-[3-[(2-hydroxy-2-phenyl-ethyl)amino]-1-(phenylcarbamoyl)propyl]imidazol-1-yl]methyl]benzoic acid methyl ester Formula: C30H32N4O4 MolecularWeight: 512.59948

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2C=CN=C2C(CCNCC(C3=CC=CC=C3)O)C(=O)NC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2C=CN=C2C(CCNCC(C3=CC=CC=C3)O)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C30H32N4O4/c1-38-30(37)24-14-12-22(13-15-24)21-34-19-18-32-28(34)26(29(36)33-25-10-6-3-7-11-25)16-17-31-20-27(35)23-8-4-2-5-9-23/h2-15,18-19,26-27,31,35H,16-17,20-21H2,1H3,(H,33,36)