methyl 4-[[3-(3-imidazol-1-ylpropyl)-5-methyl-5-naphthalen-1-yl-2,4-bis(oxidanylidene)imidazolidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[3-(3-imidazol-1-ylpropyl)-5-methyl-5-naphthalen-1-yl-2,4-bis(oxidanylidene)imidazolidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3-(3-imidazol-1-ylpropyl)-5-methyl-5-(1-naphthyl)-2,4-dioxo-imidazolidin-1-yl]methyl]benzoate CAS Name: 4-[[3-[3-(1-imidazolyl)propyl]-5-methyl-5-(1-naphthalenyl)-2,4-dioxo-1-imidazolidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(3-imidazol-1-ylpropyl)-5-methyl-5-naphthalen-1-yl-2,4-dioxoimidazolidin-1-yl]methyl]benzoate Traditional Name: 4-[[3-(3-imidazol-1-ylpropyl)-2,4-diketo-5-methyl-5-(1-naphthyl)imidazolidin-1-yl]methyl]benzoic acid methyl ester Formula: C29H28N4O4 MolecularWeight: 496.55702

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1CC2=CC=C(C=C2)C(=O)OC)CCCN3C=CN=C3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1(C(=O)N(C(=O)N1CC2=CC=C(C=C2)C(=O)OC)CCCN3C=CN=C3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H28N4O4/c1-29(25-10-5-8-22-7-3-4-9-24(22)25)27(35)32(17-6-16-31-18-15-30-20-31)28(36)33(29)19-21-11-13-23(14-12-21)26(34)37-2/h3-5,7-15,18,20H,6,16-17,19H2,1-2H3