N-[2-tert-butyl-5-(imidazol-1-ylmethyl)phenyl]-2-(9H-xanthen-9-yl)ethanamide hydrochloride

Systemtic Name: N-[2-tert-butyl-5-(imidazol-1-ylmethyl)phenyl]-2-(9H-xanthen-9-yl)ethanamide hydrochloride Openeye Name: N-[2-tert-butyl-5-(imidazol-1-ylmethyl)phenyl]-2-(9H-xanthen-9-yl)acetamide hydrochloride CAS Name: N-[2-tert-butyl-5-(1-imidazolylmethyl)phenyl]-2-(9H-xanthen-9-yl)acetamide hydrochloride IUPAC Name: N-[2-tert-butyl-5-(imidazol-1-ylmethyl)phenyl]-2-(9H-xanthen-9-yl)acetamide hydrochloride Traditional Name: N-[2-tert-butyl-5-(imidazol-1-ylmethyl)phenyl]-2-(9H-xanthen-9-yl)acetamide hydrochloride Formula: C29H30ClN3O2 MolecularWeight: 488.0204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)CN2C=CN=C2)NC(=O)CC3C4=CC=CC=C4OC5=CC=CC=C35.Cl

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)CN2C=CN=C2)NC(=O)CC3C4=CC=CC=C4OC5=CC=CC=C35.Cl

InChI

InChI=1S/C29H29N3O2.ClH/c1-29(2,3)24-13-12-20(18-32-15-14-30-19-32)16-25(24)31-28(33)17-23-21-8-4-6-10-26(21)34-27-11-7-5-9-22(23)27;/h4-16,19,23H,17-18H2,1-3H3,(H,31,33);1H