butyl 3-imidazol-1-yl-2,2-dimethyl-3-[4-(naphthalen-2-ylamino)phenyl]propanoate

Systemtic Name: butyl 3-imidazol-1-yl-2,2-dimethyl-3-[4-(naphthalen-2-ylamino)phenyl]propanoate Openeye Name: butyl 3-imidazol-1-yl-2,2-dimethyl-3-[4-(2-naphthylamino)phenyl]propanoate CAS Name: 3-(1-imidazolyl)-2,2-dimethyl-3-[4-(2-naphthalenylamino)phenyl]propanoic acid butyl ester IUPAC Name: butyl 3-imidazol-1-yl-2,2-dimethyl-3-[4-(naphthalen-2-ylamino)phenyl]propanoate Traditional Name: 3-imidazol-1-yl-2,2-dimethyl-3-[4-(2-naphthylamino)phenyl]propionic acid butyl ester Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)(C)C(C1=CC=C(C=C1)NC2=CC3=CC=CC=C3C=C2)N4C=CN=C4

Isomeric SMILES

CCCCOC(=O)C(C)(C)C(C1=CC=C(C=C1)NC2=CC3=CC=CC=C3C=C2)N4C=CN=C4

InChI

InChI=1S/C28H31N3O2/c1-4-5-18-33-27(32)28(2,3)26(31-17-16-29-20-31)22-11-13-24(14-12-22)30-25-15-10-21-8-6-7-9-23(21)19-25/h6-17,19-20,26,30H,4-5,18H2,1-3H3